#METABOLOMICS WORKBENCH cararolopes_20250320_081318 DATATRACK_ID:5755 STUDY_ID:ST003888 ANALYSIS_ID:AN006386 PROJECT_ID:PR002436 VERSION 1 CREATED_ON April 29, 2025, 9:28 pm #PROJECT PR:PROJECT_TITLE Respiration defects limit serine synthesis required for lung cancer growth and PR:PROJECT_TITLE survival PR:PROJECT_TYPE In vivo Isotope Tracing PR:PROJECT_SUMMARY Mitochondrial function supports energy and anabolic metabolism. Pathogenic PR:PROJECT_SUMMARY mitochondrial DNA (mtDNA) mutations impair these processes, causing PR:PROJECT_SUMMARY mitochondrial diseases. Their role in human cancers is less clear; while some PR:PROJECT_SUMMARY cancers harbor high mtDNA mutation burden, others do not. Here we show that a PR:PROJECT_SUMMARY proofreading mutant of DNA polymerase gamma (PolGD256A) increases the mtDNA PR:PROJECT_SUMMARY mutation burden in non-small-cell lung cancer (NSCLC). This mutation promotes PR:PROJECT_SUMMARY the accumulation of defective mitochondria, reduces tumor cell proliferation and PR:PROJECT_SUMMARY viability, and improves cancer survival. In NSCLC, pathogenic mtDNA mutations PR:PROJECT_SUMMARY enhance glycolysis and create a glucose dependency to support mitochondrial PR:PROJECT_SUMMARY energy, but at the expense of a lower NAD⁺/NADH ratio that hinders de novo PR:PROJECT_SUMMARY serine synthesis. Thus, mitochondrial function in NSCLC is essential for PR:PROJECT_SUMMARY maintaining adequate serine synthesis, which in turn supports the anabolic PR:PROJECT_SUMMARY metabolism and redox homeostasis required for tumor growth, explaining why these PR:PROJECT_SUMMARY cancers preserve functional mtDNA. PR:INSTITUTE Rutgers University PR:DEPARTMENT Rutgers Cancer Institute PR:LABORATORY Eileen White PR:LAST_NAME Cararo Lopes PR:FIRST_NAME Eduardo PR:ADDRESS 195 Little Albany Street PR:EMAIL edu.llopes@gmail.com PR:PHONE 732-235-5795 PR:FUNDING_SOURCE NIH PR:PUBLICATIONS Respiration defects limit serine synthesis required for lung cancer growth and PR:PUBLICATIONS survival #STUDY ST:STUDY_TITLE Respiration defects limit serine synthesis required for lung cancer growth and ST:STUDY_TITLE survival - Effect of Polg mutation in NSCLC Tissues_Muscle ST:STUDY_SUMMARY Here we found that mitochondria impairment causes more use of glucose to ST:STUDY_SUMMARY synthesize serine in NSCLC tumors but not in other tissues (lungs, liver, ST:STUDY_SUMMARY plasma, and muscle. Due the lack of carbons from glucose to TCA (Tricarboxylic ST:STUDY_SUMMARY acid cycle) the PGKP cells have an energetic imbalance. WT: Wild Type animals ST:STUDY_SUMMARY KP: NSCLC conditional animals PolG: Animals with PolG mutation PGKP: NSCLC ST:STUDY_SUMMARY conditional animals with PolG mutation ST:INSTITUTE Rutgers University ST:DEPARTMENT Rutgers Cancer Institute ST:LABORATORY Eileen White ST:LAST_NAME Lopes ST:FIRST_NAME Eduardo ST:ADDRESS 195 Little Albany Street ST:EMAIL edu.llopes@gmail.com ST:PHONE 732-235-5795 #SUBJECT SU:SUBJECT_TYPE Mammal SU:SUBJECT_SPECIES Mus musculus SU:TAXONOMY_ID 10090 SU:GENDER Male and female #SUBJECT_SAMPLE_FACTORS: SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Raw file names and additional sample data SUBJECT_SAMPLE_FACTORS - wt_5015_Mu_C_wt_Control Diet:Control | Sample source:Muscle | Genotype:wt RAW_FILE_NAME(Raw)=wt_5015_Mu_C SUBJECT_SAMPLE_FACTORS - wt_5017_Mu_C_wt_Control Diet:Control | Sample source:Muscle | Genotype:wt RAW_FILE_NAME(Raw)=wt_5017_Mu_C SUBJECT_SAMPLE_FACTORS - wt_5018_Mu_C_wt_Control Diet:Control | Sample source:Muscle | Genotype:wt RAW_FILE_NAME(Raw)=wt_5018_Mu_C SUBJECT_SAMPLE_FACTORS - wt_5019_Mu_C_wt_Control Diet:Control | Sample source:Muscle | Genotype:wt RAW_FILE_NAME(Raw)=wt_5019_Mu_C SUBJECT_SAMPLE_FACTORS - wt_5106_Mu_C_wt_Control Diet:Control | Sample source:Muscle | Genotype:wt RAW_FILE_NAME(Raw)=wt_5106_Mu_C SUBJECT_SAMPLE_FACTORS - wt_5103_Mu_woSG_wt_Ser/Gly free Diet:Ser/Gly free | Sample source:Muscle | Genotype:wt RAW_FILE_NAME(Raw)=wt_5103_Mu_woSG SUBJECT_SAMPLE_FACTORS - wt_5104_Mu_woSG_wt_Ser/Gly free Diet:Ser/Gly free | Sample source:Muscle | Genotype:wt RAW_FILE_NAME(Raw)=wt_5104_Mu_woSG SUBJECT_SAMPLE_FACTORS - wt_5105_Mu_woSG_wt_Ser/Gly free Diet:Ser/Gly free | Sample source:Muscle | Genotype:wt RAW_FILE_NAME(Raw)=wt_5105_Mu_woSG SUBJECT_SAMPLE_FACTORS - wt_5107_Mu_woSG_wt_Ser/Gly free Diet:Ser/Gly free | Sample source:Muscle | Genotype:wt RAW_FILE_NAME(Raw)=wt_5107_Mu_woSG SUBJECT_SAMPLE_FACTORS - wt_5108_Mu_woSG_wt_Ser/Gly free Diet:Ser/Gly free | Sample source:Muscle | Genotype:wt RAW_FILE_NAME(Raw)=wt_5108_Mu_woSG SUBJECT_SAMPLE_FACTORS - wt_5109_Mu_woSG_wt_Ser/Gly free Diet:Ser/Gly free | Sample source:Muscle | Genotype:wt RAW_FILE_NAME(Raw)=wt_5109_Mu_woSG SUBJECT_SAMPLE_FACTORS - wt_6542_Mu_woSG_wt_Ser/Gly free Diet:Ser/Gly free | Sample source:Muscle | Genotype:wt RAW_FILE_NAME(Raw)=wt_6542_Mu_woSG SUBJECT_SAMPLE_FACTORS - KP_5020_Mu_C_KP_Control Diet:Control | Sample source:Muscle | Genotype:KP RAW_FILE_NAME(Raw)=KP_5020_Mu_C SUBJECT_SAMPLE_FACTORS - KP_5021_Mu_C_KP_Control Diet:Control | Sample source:Muscle | Genotype:KP RAW_FILE_NAME(Raw)=KP_5021_Mu_C SUBJECT_SAMPLE_FACTORS - KP_5022_Mu_C_KP_Control Diet:Control | Sample source:Muscle | Genotype:KP RAW_FILE_NAME(Raw)=KP_5022_Mu_C SUBJECT_SAMPLE_FACTORS - KP_5155_Mu_C_KP_Control Diet:Control | Sample source:Muscle | Genotype:KP RAW_FILE_NAME(Raw)=KP_5155_Mu_C SUBJECT_SAMPLE_FACTORS - KP_5156_Mu_C_KP_Control Diet:Control | Sample source:Muscle | Genotype:KP RAW_FILE_NAME(Raw)=KP_5156_Mu_C SUBJECT_SAMPLE_FACTORS - KP_3327_Mu_woSG_KP_Ser/Gly free Diet:Ser/Gly free | Sample source:Muscle | Genotype:KP RAW_FILE_NAME(Raw)=KP_3327_Mu_woSG SUBJECT_SAMPLE_FACTORS - KP_3370_Mu_woSG_KP_Ser/Gly free Diet:Ser/Gly free | Sample source:Muscle | Genotype:KP RAW_FILE_NAME(Raw)=KP_3370_Mu_woSG SUBJECT_SAMPLE_FACTORS - KP_3371_Mu_woSG_KP_Ser/Gly free Diet:Ser/Gly free | Sample source:Muscle | Genotype:KP RAW_FILE_NAME(Raw)=KP_3371_Mu_woSG SUBJECT_SAMPLE_FACTORS - KP_3425_Mu_woSG_KP_Ser/Gly free Diet:Ser/Gly free | Sample source:Muscle | Genotype:KP RAW_FILE_NAME(Raw)=KP_3425_Mu_woSG SUBJECT_SAMPLE_FACTORS - KP_3430_Mu_woSG_KP_Ser/Gly free Diet:Ser/Gly free | Sample source:Muscle | Genotype:KP RAW_FILE_NAME(Raw)=KP_3430_Mu_woSG SUBJECT_SAMPLE_FACTORS - KP_5167_Mu_woSG_KP_Ser/Gly free Diet:Ser/Gly free | Sample source:Muscle | Genotype:KP RAW_FILE_NAME(Raw)=KP_5167_Mu_woSG SUBJECT_SAMPLE_FACTORS - KP_5169_Mu_woSG_KP_Ser/Gly free Diet:Ser/Gly free | Sample source:Muscle | Genotype:KP RAW_FILE_NAME(Raw)=KP_5169_Mu_woSG SUBJECT_SAMPLE_FACTORS - AA_4894_Mu_C_PolG_Control Diet:Control | Sample source:Muscle | Genotype:PolG RAW_FILE_NAME(Raw)=AA_4894_Mu_C SUBJECT_SAMPLE_FACTORS - AA_4946_Mu_C_PolG_Control Diet:Control | Sample source:Muscle | Genotype:PolG RAW_FILE_NAME(Raw)=AA_4946_Mu_C SUBJECT_SAMPLE_FACTORS - AA_4993_Mu_C_PolG_Control Diet:Control | Sample source:Muscle | Genotype:PolG RAW_FILE_NAME(Raw)=AA_4993_Mu_C SUBJECT_SAMPLE_FACTORS - AA_4996_Mu_C_PolG_Control Diet:Control | Sample source:Muscle | Genotype:PolG RAW_FILE_NAME(Raw)=AA_4996_Mu_C SUBJECT_SAMPLE_FACTORS - AA_4997_Mu_C_PolG_Control Diet:Control | Sample source:Muscle | Genotype:PolG RAW_FILE_NAME(Raw)=AA_4997_Mu_C SUBJECT_SAMPLE_FACTORS - AA_5098_Mu_C_PolG_Control Diet:Control | Sample source:Muscle | Genotype:PolG RAW_FILE_NAME(Raw)=AA_5098_Mu_C SUBJECT_SAMPLE_FACTORS - AA_4828_Mu_woSG_PolG_Ser/Gly free Diet:Ser/Gly free | Sample source:Muscle | Genotype:PolG RAW_FILE_NAME(Raw)=AA_4828_Mu_woSG SUBJECT_SAMPLE_FACTORS - AA_4829_Mu_woSG_PolG_Ser/Gly free Diet:Ser/Gly free | Sample source:Muscle | Genotype:PolG RAW_FILE_NAME(Raw)=AA_4829_Mu_woSG SUBJECT_SAMPLE_FACTORS - AA_4981_Mu_woSG_PolG_Ser/Gly free Diet:Ser/Gly free | Sample source:Muscle | Genotype:PolG RAW_FILE_NAME(Raw)=AA_4981_Mu_woSG SUBJECT_SAMPLE_FACTORS - AA_4954_Mu_woSG_PolG_Ser/Gly free Diet:Ser/Gly free | Sample source:Muscle | Genotype:PolG RAW_FILE_NAME(Raw)=AA_4954_Mu_woSG SUBJECT_SAMPLE_FACTORS - AA_4984_Mu_woSG_PolG_Ser/Gly free Diet:Ser/Gly free | Sample source:Muscle | Genotype:PolG RAW_FILE_NAME(Raw)=AA_4984_Mu_woSG SUBJECT_SAMPLE_FACTORS - AA_5009_Mu_woSG_PolG_Ser/Gly free Diet:Ser/Gly free | Sample source:Muscle | Genotype:PolG RAW_FILE_NAME(Raw)=AA_5009_Mu_woSG SUBJECT_SAMPLE_FACTORS - AAK_4896_Mu_C_PGKP_Control Diet:Control | Sample source:Muscle | Genotype:PGKP RAW_FILE_NAME(Raw)=AAK_4896_Mu_C SUBJECT_SAMPLE_FACTORS - AAK_4898_Mu_C_PGKP_Control Diet:Control | Sample source:Muscle | Genotype:PGKP RAW_FILE_NAME(Raw)=AAK_4898_Mu_C SUBJECT_SAMPLE_FACTORS - AAK_4900_Mu_C_PGKP_Control Diet:Control | Sample source:Muscle | Genotype:PGKP RAW_FILE_NAME(Raw)=AAK_4900_Mu_C SUBJECT_SAMPLE_FACTORS - AAK_4942_Mu_C_PGKP_Control Diet:Control | Sample source:Muscle | Genotype:PGKP RAW_FILE_NAME(Raw)=AAK_4942_Mu_C SUBJECT_SAMPLE_FACTORS - AAK_5004_Mu_C_PGKP_Control Diet:Control | Sample source:Muscle | Genotype:PGKP RAW_FILE_NAME(Raw)=AAK_5004_Mu_C SUBJECT_SAMPLE_FACTORS - AAK_5005_Mu_C_PGKP_Control Diet:Control | Sample source:Muscle | Genotype:PGKP RAW_FILE_NAME(Raw)=AAK_5005_Mu_C SUBJECT_SAMPLE_FACTORS - AAK_5013_Mu_C_PGKP_Control Diet:Control | Sample source:Muscle | Genotype:PGKP RAW_FILE_NAME(Raw)=AAK_5013_Mu_C SUBJECT_SAMPLE_FACTORS - AAK_4830_Mu_woSG_PGKP_Ser/Gly free Diet:Ser/Gly free | Sample source:Muscle | Genotype:PGKP RAW_FILE_NAME(Raw)=AAK_4830_Mu_woSG SUBJECT_SAMPLE_FACTORS - AAK_4835_Mu_woSG_PGKP_Ser/Gly free Diet:Ser/Gly free | Sample source:Muscle | Genotype:PGKP RAW_FILE_NAME(Raw)=AAK_4835_Mu_woSG SUBJECT_SAMPLE_FACTORS - AAK_4837_Mu_woSG_PGKP_Ser/Gly free Diet:Ser/Gly free | Sample source:Muscle | Genotype:PGKP RAW_FILE_NAME(Raw)=AAK_4837_Mu_woSG SUBJECT_SAMPLE_FACTORS - AAK_4838_Mu_woSG_PGKP_Ser/Gly free Diet:Ser/Gly free | Sample source:Muscle | Genotype:PGKP RAW_FILE_NAME(Raw)=AAK_4838_Mu_woSG SUBJECT_SAMPLE_FACTORS - AAK_4840_Mu_woSG_PGKP_Ser/Gly free Diet:Ser/Gly free | Sample source:Muscle | Genotype:PGKP RAW_FILE_NAME(Raw)=AAK_4840_Mu_woSG SUBJECT_SAMPLE_FACTORS - AAK_4891_Mu_woSG_PGKP_Ser/Gly free Diet:Ser/Gly free | Sample source:Muscle | Genotype:PGKP RAW_FILE_NAME(Raw)=AAK_4891_Mu_woSG SUBJECT_SAMPLE_FACTORS - AAK_4992_Mu_woSG_PGKP_Ser/Gly free Diet:Ser/Gly free | Sample source:Muscle | Genotype:PGKP RAW_FILE_NAME(Raw)=AAK_4992_Mu_woSG SUBJECT_SAMPLE_FACTORS - AAK_5359_Mu_woSG_PGKP_Ser/Gly free Diet:Ser/Gly free | Sample source:Muscle | Genotype:PGKP RAW_FILE_NAME(Raw)=AAK_5359_Mu_woSG #COLLECTION CO:COLLECTION_SUMMARY Extraction of polar metabolites from solid tissues: 20 to 30 mg of tissues were CO:COLLECTION_SUMMARY weighed and added to a 2 mL round-tipped microtube with a – 80° C cold Yttria CO:COLLECTION_SUMMARY Grinding Ball per tube. The tissues were pulverized in CryoMill (Retsch) CO:COLLECTION_SUMMARY following alternating three cycles at 5 Hz for 2 min with three cycles at 25 Hz CO:COLLECTION_SUMMARY for 2 min. Buffer was added to each 2 mL microtube (sample weight x 40)/2 volume CO:COLLECTION_SUMMARY of the buffer) 40:40:20 buffer with 0.5% formic acid, samples were vigorously CO:COLLECTION_SUMMARY vortexed and incubated on ice for 10 minutes, vortexed, and incubated for an CO:COLLECTION_SUMMARY additional 10 min. After the samples were centrifuged for 10 min at 16,000g at CO:COLLECTION_SUMMARY 4° C, the supernatant A was collected and saved, and the pellets were submitted CO:COLLECTION_SUMMARY to re-extraction following the same procedure to generate supernatant B. CO:COLLECTION_SUMMARY Supernatant A and B were mixed and transferred to a clean 1.5 mL microtube with CO:COLLECTION_SUMMARY the appropriated volume of 15% NH4CO3. The samples were stored in a -80° C CO:COLLECTION_SUMMARY freezer until analysis by LC-MS. Extraction of polar metabolites from plasma:To CO:COLLECTION_SUMMARY extract polar metabolites from mouse plasma 40 µL of cold methanol was added to CO:COLLECTION_SUMMARY a 15 µL of mouse plasma in a 1.5 mL microtube. This mixture was vortexed for 10 CO:COLLECTION_SUMMARY seconds and incubated for 20 minutes in a -20° C freezer. Samples were CO:COLLECTION_SUMMARY centrifuged for 10 min at 16,000g at 4° C. Next, supernatant A was collected in CO:COLLECTION_SUMMARY a new tube, and the pellet was saved for re-extraction. For re-extraction, the CO:COLLECTION_SUMMARY pellet was resuspended in 200 µL of 40:40:20 buffer, vortexed, and allowed to CO:COLLECTION_SUMMARY sit on ice for 10 min. The samples were centrifuged for 10 min at 16,000 g at CO:COLLECTION_SUMMARY 4° C. Supernatant B was collected and mixed with supernatant A. This mixture CO:COLLECTION_SUMMARY was further processed to remove phospholipids using 1 mL Phenomenex (Phenomenex CO:COLLECTION_SUMMARY Inc.) tubes according to the manufacturer's instruction and stored at -80° C CO:COLLECTION_SUMMARY until analysis by LC-MS. CO:SAMPLE_TYPE Muscle CO:VOLUMEORAMOUNT_COLLECTED 1mL of organic phase of metabolites extraction CO:STORAGE_CONDITIONS -80℃ CO:COLLECTION_VIALS 1.5 mL Eppendorf tubes CO:STORAGE_VIALS 1.5 mL Eppendorf tubes #TREATMENT TR:TREATMENT_SUMMARY The animals were weighed one week before NSCLC induction. In the same period, TR:TREATMENT_SUMMARY special diets (control amino acid food and ser/gly free diet) were provided and TR:TREATMENT_SUMMARY kept until the end of the experiment (12 weeks). After this period the animals TR:TREATMENT_SUMMARY were subjected to [U13C]-Glucose infusion for 2h30. Therefore the animals were TR:TREATMENT_SUMMARY euthanized and have their tissues collected. Muscle (gastrocnemius), liver, TR:TREATMENT_SUMMARY plasma, lung or tumors. #SAMPLEPREP SP:SAMPLEPREP_SUMMARY For Muscle: 20 to 30 mg of tissues were weighed and added to a 2 mL round-tipped SP:SAMPLEPREP_SUMMARY microtube with a – 80° C cold Yttria Grinding Ball per tube. The tissues were SP:SAMPLEPREP_SUMMARY pulverized in CryoMill (Retsch) following alternating three cycles at 5 Hz for 2 SP:SAMPLEPREP_SUMMARY min with three cycles at 25 Hz for 2 min. Buffer was added to each 2 mL SP:SAMPLEPREP_SUMMARY microtube (sample weight x 40)/2 volume of the buffer) 40:40:20 buffer with 0.5% SP:SAMPLEPREP_SUMMARY formic acid, samples were vigorously vortexed and incubated on ice for 10 SP:SAMPLEPREP_SUMMARY minutes, vortexed, and incubated for an additional 10 min. After the samples SP:SAMPLEPREP_SUMMARY were centrifuged for 10 min at 16,000g at 4° C, the supernatant A was collected SP:SAMPLEPREP_SUMMARY and saved, and the pellets were submitted to re-extraction following the same SP:SAMPLEPREP_SUMMARY procedure to generate supernatant B. Supernatant A and B were mixed and SP:SAMPLEPREP_SUMMARY transferred to a clean 1.5 mL microtube with the appropriated volume of 15% SP:SAMPLEPREP_SUMMARY NH4CO3. The samples were stored in a -80° C freezer until analysis by LC-MS. SP:SAMPLEPREP_SUMMARY For Plasma: To extract polar metabolites from mouse plasma 40 µL of cold SP:SAMPLEPREP_SUMMARY methanol was added to a 15 µL of mouse plasma in a 1.5 mL microtube. This SP:SAMPLEPREP_SUMMARY mixture was vortexed for 10 seconds and incubated for 20 minutes in a -20° C SP:SAMPLEPREP_SUMMARY freezer. Samples were centrifuged for 10 min at 16,000g at 4° C. Next, SP:SAMPLEPREP_SUMMARY supernatant A was collected in a new tube, and the pellet was saved for SP:SAMPLEPREP_SUMMARY re-extraction. For re-extraction, the pellet was resuspended in 200 µL of SP:SAMPLEPREP_SUMMARY 40:40:20 buffer, vortexed, and allowed to sit on ice for 10 min. The samples SP:SAMPLEPREP_SUMMARY were centrifuged for 10 min at 16,000 g at 4° C. Supernatant B was collected SP:SAMPLEPREP_SUMMARY and mixed with supernatant A. This mixture was further processed to remove SP:SAMPLEPREP_SUMMARY phospholipids using 1 mL Phenomenex (Phenomenex Inc.) tubes according to the SP:SAMPLEPREP_SUMMARY manufacturer's instruction and stored at -80° C until analysis by LC-MS. #CHROMATOGRAPHY CH:CHROMATOGRAPHY_SUMMARY Muscle CH:CHROMATOGRAPHY_TYPE HILIC CH:INSTRUMENT_NAME Thermo Vanquish CH:COLUMN_NAME Waters XBridge BEH Amide (150 × 2.1mm, 2.5um) CH:SOLVENT_A 95% water/5% acetonitrile; 20mM acetic acid; 40mM ammonium hydroxide (pH 9.4) CH:SOLVENT_B 20% water/80% acetonitrile; 20mM acetic acid, 40mM ammonium hydroxide (pH 9.4) CH:FLOW_GRADIENT 0 min, 100% B; 3 min, 100% B; 3.2 min, 90% B; 6.2 min, 90% B; 6.5 min, 80% B; CH:FLOW_GRADIENT 10.5 min, 80% B; 10.7 min, 70% B; 13.5 min, 70% B; 13.7 min, 45% B; 16 min, 45% CH:FLOW_GRADIENT B; 16.5 min, 100% B; and 22 min, 100% B CH:FLOW_RATE 300 μL/min CH:COLUMN_TEMPERATURE 25 °C CH:METHODS_FILENAME Chromatography_method.pdf #ANALYSIS AN:ANALYSIS_TYPE MS #MS MS:INSTRUMENT_NAME Thermo Q Exactive Plus Orbitrap MS:INSTRUMENT_TYPE Orbitrap MS:MS_TYPE ESI MS:ION_MODE POSITIVE MS:MS_COMMENTS Maven #MS_METABOLITE_DATA MS_METABOLITE_DATA:UNITS ion count MS_METABOLITE_DATA_START Samples AA_4828_Mu_woSG_PolG_Ser/Gly free AA_4829_Mu_woSG_PolG_Ser/Gly free AA_4894_Mu_C_PolG_Control AA_4946_Mu_C_PolG_Control AA_4954_Mu_woSG_PolG_Ser/Gly free AA_4981_Mu_woSG_PolG_Ser/Gly free AA_4984_Mu_woSG_PolG_Ser/Gly free AA_4993_Mu_C_PolG_Control AA_4996_Mu_C_PolG_Control AA_4997_Mu_C_PolG_Control AA_5009_Mu_woSG_PolG_Ser/Gly free AA_5098_Mu_C_PolG_Control AAK_4830_Mu_woSG_PGKP_Ser/Gly free AAK_4835_Mu_woSG_PGKP_Ser/Gly free AAK_4837_Mu_woSG_PGKP_Ser/Gly free AAK_4838_Mu_woSG_PGKP_Ser/Gly free AAK_4840_Mu_woSG_PGKP_Ser/Gly free AAK_4891_Mu_woSG_PGKP_Ser/Gly free AAK_4896_Mu_C_PGKP_Control AAK_4898_Mu_C_PGKP_Control AAK_4900_Mu_C_PGKP_Control AAK_4942_Mu_C_PGKP_Control AAK_4992_Mu_woSG_PGKP_Ser/Gly free AAK_5004_Mu_C_PGKP_Control AAK_5005_Mu_C_PGKP_Control AAK_5013_Mu_C_PGKP_Control AAK_5359_Mu_woSG_PGKP_Ser/Gly free KP_3327_Mu_woSG_KP_Ser/Gly free KP_3370_Mu_woSG_KP_Ser/Gly free KP_3371_Mu_woSG_KP_Ser/Gly free KP_3425_Mu_woSG_KP_Ser/Gly free KP_3430_Mu_woSG_KP_Ser/Gly free KP_5020_Mu_C_KP_Control KP_5021_Mu_C_KP_Control KP_5022_Mu_C_KP_Control KP_5155_Mu_C_KP_Control KP_5156_Mu_C_KP_Control KP_5167_Mu_woSG_KP_Ser/Gly free KP_5169_Mu_woSG_KP_Ser/Gly free wt_5015_Mu_C_wt_Control wt_5017_Mu_C_wt_Control wt_5018_Mu_C_wt_Control wt_5019_Mu_C_wt_Control wt_5103_Mu_woSG_wt_Ser/Gly free wt_5104_Mu_woSG_wt_Ser/Gly free wt_5105_Mu_woSG_wt_Ser/Gly free wt_5106_Mu_C_wt_Control wt_5107_Mu_woSG_wt_Ser/Gly free wt_5108_Mu_woSG_wt_Ser/Gly free wt_5109_Mu_woSG_wt_Ser/Gly free wt_6542_Mu_woSG_wt_Ser/Gly free Factors Diet:Ser/Gly free | Sample source:Muscle | Genotype:PolG Diet:Ser/Gly free | Sample source:Muscle | Genotype:PolG Diet:Control | Sample source:Muscle | Genotype:PolG Diet:Control | Sample source:Muscle | Genotype:PolG Diet:Ser/Gly free | Sample source:Muscle | Genotype:PolG Diet:Ser/Gly free | Sample source:Muscle | Genotype:PolG Diet:Ser/Gly free | Sample source:Muscle | Genotype:PolG Diet:Control | Sample source:Muscle | Genotype:PolG Diet:Control | Sample source:Muscle | Genotype:PolG Diet:Control | Sample source:Muscle | Genotype:PolG Diet:Ser/Gly free | Sample source:Muscle | Genotype:PolG Diet:Control | Sample source:Muscle | Genotype:PolG Diet:Ser/Gly free | Sample source:Muscle | Genotype:PGKP Diet:Ser/Gly free | Sample source:Muscle | Genotype:PGKP Diet:Ser/Gly free | Sample source:Muscle | Genotype:PGKP Diet:Ser/Gly free | Sample source:Muscle | Genotype:PGKP Diet:Ser/Gly free | Sample source:Muscle | Genotype:PGKP Diet:Ser/Gly free | Sample source:Muscle | Genotype:PGKP Diet:Control | Sample source:Muscle | Genotype:PGKP Diet:Control | Sample source:Muscle | Genotype:PGKP Diet:Control | Sample source:Muscle | Genotype:PGKP Diet:Control | Sample source:Muscle | Genotype:PGKP Diet:Ser/Gly free | Sample source:Muscle | Genotype:PGKP Diet:Control | Sample source:Muscle | Genotype:PGKP Diet:Control | Sample source:Muscle | Genotype:PGKP Diet:Control | Sample source:Muscle | Genotype:PGKP Diet:Ser/Gly free | Sample source:Muscle | Genotype:PGKP Diet:Ser/Gly free | Sample source:Muscle | Genotype:KP Diet:Ser/Gly free | Sample source:Muscle | Genotype:KP Diet:Ser/Gly free | Sample source:Muscle | Genotype:KP Diet:Ser/Gly free | Sample source:Muscle | Genotype:KP Diet:Ser/Gly free | Sample source:Muscle | Genotype:KP Diet:Control | Sample source:Muscle | Genotype:KP Diet:Control | Sample source:Muscle | Genotype:KP Diet:Control | Sample source:Muscle | Genotype:KP Diet:Control | Sample source:Muscle | Genotype:KP Diet:Control | Sample source:Muscle | Genotype:KP Diet:Ser/Gly free | Sample source:Muscle | Genotype:KP Diet:Ser/Gly free | Sample source:Muscle | Genotype:KP Diet:Control | Sample source:Muscle | Genotype:wt Diet:Control | Sample source:Muscle | Genotype:wt Diet:Control | Sample source:Muscle | Genotype:wt Diet:Control | Sample source:Muscle | Genotype:wt Diet:Ser/Gly free | Sample source:Muscle | Genotype:wt Diet:Ser/Gly free | Sample source:Muscle | Genotype:wt Diet:Ser/Gly free | Sample source:Muscle | Genotype:wt Diet:Control | Sample source:Muscle | Genotype:wt Diet:Ser/Gly free | Sample source:Muscle | Genotype:wt Diet:Ser/Gly free | Sample source:Muscle | Genotype:wt Diet:Ser/Gly free | Sample source:Muscle | Genotype:wt Diet:Ser/Gly free | Sample source:Muscle | Genotype:wt 2-Aminoadipic acid_C12 PARENT 3718413 243108 2806736 3365481 5073546 2624844 477606 545595 4035695 3266026 4311683 1563048 4872057 5856655 2661206 5314864 3455903 4661325 2107471 417856 4032257 5220239 295942 3287318 6297721 263613 2874046 7029301 4547025 6055749 5757384 4513039 3812694 4336096 4473791 414683 1698565 5680355 477895 2503076 591723 497356 4024933 2484168 5001361 2722619 375157 3869218 4088895 3325719 5629108 2-Aminoadipic acid_C13-label-1 118188 10427 108442 10774 320727 179827 216196 270983 20716 202014 279343 99918 351714 366837 168887 360794 239044 294754 1324 287197 237536 245693 111217 289072 427121 114977 101083 435275 277353 257391 370768 211249 111311 123225 343267 192492 155488 354092 389568 196882 331709 127477 223901 105188 24364 124201 319046 139549 167893 130968 375855 2-methylcitrate_C12 PARENT 401631 1208119 379129 270639 786459 428394 1162425 217629 234761 523805 553917 1990304 540761 26711 442399 437349 362712 759637 8269 230883 95925 89091 908648 212674 434182 137856 754834 1735261 911256 1651573 93751 1350049 518791 23661 901604 768018 590548 176588 1204657 336877 910984 786986 740878 812814 1641918 1173931 762224 750758 884877 741184 128911 3 5-cAMP_C12 PARENT 349382 307441 431186 41335 531743 576911 448867 456875 684413 593931 447458 547034 624834 508948 442418 851385 546491 348627 535467 797776 596187 53496 323734 798839 658675 266501 326445 289785 475752 239073 258875 37368 389086 223186 402038 120757 163178 393926 386709 97304 416489 301684 305943 267626 246294 18139 7362 431559 337385 2532 38081 3 5-cAMP_C13-label-1 0 0 71838 0 0 64124 0 62441 0 84487 60424 61232 0 75829 67695 0 0 0 78075 76649 0 6923 0 0 0 52105 0 69059 0 68044 0 0 68479 6178 0 0 61361 71669 0 0 55474 63568 0 0 67208 0 78611 70708 0 65703 0 3 5-cAMP_C13-label-8 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 57842 0 0 0 0 0 0 0 0 0 0 0 0 0 0 63797 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3-Cresotinic acid_C12 PARENT 760528 874214 782906 705768 1191879 1101168 1318421 748477 116993 83895 571776 739128 736596 868523 748387 1016488 781346 874505 1149339 2334247 1162352 981451 806742 790217 1034617 84836 925405 90106 1257574 1274692 1512398 1826746 533203 673969 1066284 1445355 1248612 1327315 872167 873869 885853 1414612 1125338 1339495 110062 1587321 887719 1393854 1281903 1399238 172232 3-Cresotinic acid_C13-label-1 79911 7387 6543 0 62514 0 0 0 59052 64318 0 0 66884 89395 0 0 0 78593 0 973 71101 90484 0 78602 0 0 6898 0 0 0 76911 81086 0 0 66669 61388 105689 75673 0 0 0 0 0 73934 67887 0 68157 81789 157225 97386 73241 4-Guanidinobutyrate_C12 PARENT 4453129 24117464 4196612 6221108 5627811 4258524 4913775 942965 4370165 4322484 11892972 603647 6686973 5014143 417222 6579624 3497687 3796673 5895267 4290435 3317469 3452914 4039093 3675274 3155497 3506451 5536395 3318718 2551716 676663 5826405 5498298 3732707 4216073 3182224 42162 426926 3634261 4764421 3756744 345389 3430956 3318226 15243038 6528462 16253777 5671425 4304023 10860288 85826 5080096 4-Guanidinobutyrate_C13-label-1 132042 1704524 0 105168 0 154761 206021 587635 427235 88779 591762 145155 273176 175862 0 294109 0 0 96772 0 66996 0 198239 8928 63702 0 30757 0 0 232093 242637 257241 0 69038 0 0 176841 275914 196909 0 0 336905 0 904997 217276 444665 180052 0 397827 611842 145915 5-Deoxy-5-(methylthio)adenosine_C12 PARENT 309212 4486817 5184619 4854441 4660457 41238 9982818 5656161 5104194 5705709 3651282 18013925 4529008 4704769 4385714 4421782 4471025 4800213 877718 4578186 6727554 6870897 3235676 5329594 529362 5085374 2953551 31445 215147 2772449 2459471 3091737 4572882 3076602 2993973 6727056 19057 3306246 3793655 3215076 3085044 3021344 2694097 2733917 3017683 3423954 2955593 3437499 2511754 3936042 4399376 5-Deoxy-5-(methylthio)adenosine_C13-label-1 309032 381916 438574 367155 537272 473636 1245267 481323 761072 424078 584001 1813492 537361 568971 183579 173821 361863 544908 461484 298935 1030611 768548 206397 528137 777272 340157 176194 4300 183061 225566 152861 312462 169784 184773 201198 404029 9216 367243 231537 38369 448393 168399 253403 577145 229641 402034 333791 427946 208604 460457 133907 Acetyl-arginine_C12 PARENT 2274148 1811253 497885 4137668 2957736 1964566 2062511 6841734 410765 6582687 1996873 7567893 4945976 4652387 4544418 4300155 4247937 6345086 3441412 3074003 4193571 5608856 2008513 4275351 6247152 3507893 1960458 3164907 1935649 2673122 1677856 322213 1998581 2810702 203305 2161262 2392827 4657018 2885641 1771586 2291853 2495602 2416752 1785525 3336814 2775581 3376342 2503235 2489996 2177478 3240855 Acetyl-arginine_C13-label-1 172105 9389 457724 116639 123138 0 87576 65518 336794 556251 197072 561639 43926 30085 389099 335594 399011 36425 183699 231159 299856 444568 111297 346038 428363 15729 110322 239664 11993 117033 173242 399672 103869 108061 123455 176437 151689 491285 162801 118427 95992 176162 126486 71553 128236 195501 369654 242108 129676 247992 144072 Acetyl-arginine_C13-label-6 0 0 0 0 0 0 0 76972 0 0 83544 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 66471 0 0 0 95953 0 0 79398 0 0 0 Acetylcholine_C12 PARENT 4322525 2800944 3222523 5681259 3831114 4771964 4421334 6131604 4086374 3520221 3342017 2158807 5930972 7009877 5991867 8403716 4869666 9413259 4593732 6741076 4761682 6746936 4901964 8870801 6560509 7581457 5366986 2755047 6045325 3039898 3387862 2697522 4917853 3579339 5639294 2840779 4206623 1928637 2587983 2699193 4384505 2812379 175676 2238551 3815164 2899562 3004182 1933679 3111796 2256988 135079 Acetylcholine_C13-label-1 363033 298002 191329 522684 320938 433392 407149 475598 304211 299314 178028 93176 457804 562273 578531 714127 489273 769336 291645 463008 412824 570859 22488 680104 474357 585749 426095 201855 419104 355635 231415 108638 427384 346447 35556 167899 326946 181091 16126 174107 50616 335666 84537 1804 339578 187144 143812 174569 316738 142056 92307 Aconitate_C12 PARENT 1509637 691601 805034 1046422 195502 135978 1155144 1660258 1749818 1333775 1615144 673712 1049997 1590624 1935331 1777119 1654378 1699629 850687 1755265 1485483 2030285 966087 1704718 1941998 1657631 1605488 1853168 204488 1536095 11387 1077258 2070641 975609 1586946 951042 833433 1854657 156634 1691185 2281446 1605716 1613288 1069698 146122 1269193 1345635 1564789 149832 1419994 1733736 Aconitate_C13-label-1 77557 0 98427 10236 0 0 0 0 0 0 0 82215 0 0 51192 0 0 0 0 0 69493 0 0 0 73443 0 86987 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 Adenine_C12 PARENT 17031233 8344211 12215841 10944715 17524705 15380283 20329288 9802337 11062125 848692 8703173 19284088 11108087 34641791 13093191 17535686 17814217 35607847 73396706 24516355 22944123 17070786 6867826 15779377 21673888 28409112 8407852 12311927 10684881 7746643 10271656 10355807 1153829 10302755 8542754 1475122 9183391 9642134 8259829 10445743 13560092 10839744 8342063 9776256 11028841 896464 7496988 7842784 9592022 6183685 8646028 Adenine_C13-label-1 1031754 543531 82369 768155 1053868 93069 1266339 561485 842153 546465 668829 1164753 676893 1851818 747038 96529 101498 2226129 3920315 1340091 142519 929461 32518 872965 1106616 185665 429798 731645 654831 414526 659916 793364 73992 655492 556512 966373 568014 610614 507838 813436 848011 616271 54594 698799 743694 762502 584322 484562 704765 405955 624067 Adenine_C13-label-3 58663 60831 96451 69699 74204 93447 94864 44979 80942 67609 0 75356 63471 68852 46999 132869 66459 96078 172156 319706 66705 86473 56512 74893 62788 48346 84976 69703 117216 89321 106694 166777 69147 0 90546 106992 73741 123411 67944 55486 91384 117049 72572 95582 116037 123769 70427 172644 159554 93161 140534 Adenosine_C12 PARENT 7976385 13849875 8157709 1385008 38107466 28723397 20500325 24799717 24465123 15420706 34488753 18772727 31934203 15079833 16022536 219344 48700103 28078212 51353688 157987912 63112506 46776934 16398952 58183238 49781191 22231086 32011516 13564866 39431097 8584848 857457 10201218 16219389 17646027 11310503 14695181 8887303 20160155 11825971 18835642 25461777 26167305 1518207 1563718 19500186 33897812 6580577 16588106 1866475 13396186 12363559 Adenosine_C13-label-1 8420884 1580018 96373 1641514 4177775 3022863 2104518 2983979 2640091 149374 3609238 2086814 3429672 1646236 1710539 2264003 4835992 3082893 5488047 15959864 6481453 5306196 1984629 5789189 5118093 250893 3215431 1179873 4145313 1060814 890282 1055373 162432 183404 1221943 1750297 1009746 1928052 1109365 190748 3080655 2811215 1538595 1504068 225616 3270999 724594 175083 1835071 155365 149034 Adenosine_C13-label-2 405219 85058 0 0 415191 192162 77514 97095 195384 6123 267316 117238 220012 8066 76833 92764 437448 72844 380671 1314641 564338 426881 153252 342846 438052 79821 283293 91918 290912 61614 82148 89073 172808 118633 58861 70413 70884 61083 71146 89099 220626 266677 66418 129786 86718 321051 60462 81831 158574 0 68488 ADP_C12 PARENT 17854955 8204194 8037545 9168324 26124717 2314873 3382038 10697704 9559662 11330732 13762388 128947 1929913 22985105 19120167 27669866 27371612 23505614 259769 36971362 41275078 23429531 152139 25653333 24301252 21363392 12800221 18135219 3375155 11733887 10900934 12088391 20108339 40039403 26790703 14233539 18796202 1536872 10712931 18508027 18625275 10471466 8408051 11525315 7590404 8392459 9512725 10243875 10018743 7379256 1070941 ADP_C13-label-1 1761714 818073 935434 93437 265094 2495607 448739 1230064 982403 1221898 1235355 95747 2157319 2785938 2118455 3255451 2759863 2451125 2940832 4060522 4013768 2843793 1651864 2742399 2379032 2332563 1289049 1763141 3918316 1303464 1079423 1519862 2215456 4309102 2612696 1631009 2018482 1800603 1013173 1838888 2124668 1329053 1045328 1400825 1056525 939539 1095489 1025005 1174832 845993 1274121 ADP_C13-label-2 339201 125532 21832 242625 577446 701238 0 155221 223001 31555 239174 0 481295 611543 509141 718094 790327 664261 718241 932551 1111663 419668 465805 718871 539755 537419 363018 234938 864591 255455 150084 159325 482661 789509 664863 359563 352445 47761 131083 497462 476792 205169 111036 244671 112436 119374 227232 172538 97085 121602 120492 ADP_C13-label-3 0 0 0 0 0 0 0 0 0 0 0 0 0 66274 0 0 0 85748 0 94507 63506 0 0 0 0 0 0 0 0 0 0 0 0 92479 64383 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ADP-ribose_C12 PARENT 986868 395552 184751 656905 1627995 1018046 502987 356432 68908 444946 1283625 526789 1487042 232804 1296185 1341214 1915497 1569079 5093541 2209316 2605229 2897448 1360534 769595 1314578 1056272 1022845 48413 3193498 848672 765282 631702 1958059 1673612 2128383 1200814 1671872 1083649 454704 621841 666007 440433 591031 241405 490012 326926 485189 547319 577654 350449 619408 ADP-ribose_C13-label-1 0 0 0 59677 245034 176018 128109 0 63391 0 244908 0 317672 361951 206245 16217 377564 183384 927991 421367 465962 58508 22622 66153 291979 202667 154964 90722 450043 0 0 0 252294 334725 395024 127651 250771 14835 0 86219 82014 77334 0 0 0 0 0 0 0 0 0 ADP-ribose_C13-label-11 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 52752 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ADP-ribose_C13-label-2 0 0 0 0 71017 58676 0 0 0 0 0 0 0 0 0 6334 0 0 99175 0 149126 63916 0 0 0 0 0 0 70639 0 0 0 0 0 0 0 0 0 0 62334 0 0 0 0 0 0 0 0 0 0 0 Alanine_C12 PARENT 63587625 57647565 57357845 62143935 70250635 61287875 57663435 65028815 6372374 61606955 62658395 57202515 60186835 67435415 59048075 65061375 65880155 70442385 6596012 60549245 6625866 70582615 6108052 65336165 67487885 62683735 6306400 64489855 52932765 54276575 50719565 6258188 6233398 6476802 68691195 59961145 6293992 64804615 61420095 5932574 60865265 5948936 57804615 51972465 60344285 55832665 54786155 63305265 56713515 61348885 59397155 Alanine_C13-label-1 31632272 23949156 28656066 28633572 27286912 28274547 28192559 27844278 25850895 27138691 2704975 29545453 26657378 302629 24369156 25843467 2440225 24415661 28563316 22326217 28572097 27735919 2457462 24037864 28270362 23366075 27986416 22883227 16740281 19900244 20897695 24531598 21566523 22346217 2542548 21438181 25163938 22528081 23448398 20990545 20187211 23537688 21789917 23069081 22649288 20641508 19535108 23769783 20215192 22778083 23020752 Alanine_C13-label-2 7982951 5146786 9425399 8696263 4606176 8426069 6146302 5891729 5076764 58973 6832498 10152426 6414091 6734056 3240489 3766462 4360087 4903656 5982675 1949215 4611339 6004045 4528912 4034174 5968192 3597083 5748594 1126867 1254438 1423379 2881576 3437939 2822523 2626198 1231332 300891 3077695 216461 2120187 3494441 1775811 3705936 2464411 46005 3969942 3602035 3713465 37907 2718847 2796552 2319534 Alanine_C13-label-3 14832362 1254336 16282544 16671736 1206916 21917495 13208667 13137856 14120388 12447126 11482973 23271005 14003853 14981647 9533807 8295076 11690188 1273156 1356963 9861021 14721569 14569762 11894128 12562093 1533123 11412221 9357405 6928296 6743089 5440201 17852264 11565627 11711671 11644656 9916145 10891888 10364623 6694862 6946649 15417544 10758484 14389489 11380041 18624242 17455623 11947506 19610925 13061859 12796748 11059738 8215123 AMP_C12 PARENT 72896681 7529319 12823459 22663775 4111785 38787612 1576562 26348844 17953669 14747827 30172334 24651545 30050541 15689864 7749538 27420875 49447334 90338256 42841825 71466331 774685 44925847 23967736 38057662 63620631 23310212 33118166 357460 168386638 23970792 21791727 11971716 28555784 112078262 40498391 103222056 18211438 3521135 12351284 17743225 33578272 30224297 1731213 14803102 17498064 3085805 15602314 22253186 20689795 17299805 13238178 AMP_C13-label-1 7710706 882517 1291898 2410315 4438873 4509029 1560649 2745744 1986042 1744275 3096789 2581909 2987721 1712429 785316 2908413 4992197 9264844 4376919 7466003 7642346 3985011 2700349 3966111 6074765 258533 3296184 3350808 17661677 2454178 2196813 1254193 3021737 11758888 3745592 10290693 2101173 3945222 135089 1844865 3803309 331882 1703931 1538149 218364 270858 1660739 2302993 2068242 169036 1378677 AMP_C13-label-2 1207978 73675 190057 417278 608573 255395 198672 319647 419868 147884 375874 383507 507167 288673 56006 411778 62195 1275367 721101 1129825 1299055 784841 328518 719003 1158346 177014 611837 217295 2445269 333131 340165 211495 301255 2015902 529421 1926776 205096 513043 80755 272427 600784 334335 222869 108193 261117 401548 229329 310285 230747 275375 183003 AMP_C13-label-3 75073 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 72876 0 0 59633 0 0 0 0 0 0 0 92847 0 0 0 0 201707 0 664 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 AMP_C13-label-5 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 69978 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 Anserine_C12 PARENT 53411280 35785700 43238624 66589868 40655448 66629936 54883648 71332312 45365760 43483604 37130916 45430428 42619532 78483800 96932744 79945224 82565256 61336060 88976672 66624564 54396284 51702980 47077392 85756920 73217336 79441816 57972292 34844464 52953396 31111178 42717380 60696960 49112500 66422604 49567340 62328940 62613420 46760612 53083152 59395700 50596268 36226292 31166254 56485412 61736352 57589740 46035996 54179552 32601664 40362656 53920316 Anserine_C13-label-1 58093255 388993425 47022195 71621675 44088955 7174378 60195495 78007025 49029295 47240915 4015523 48946035 46369685 8506497 10432015 8444503 8750975 6616744 9546236 71542655 58279025 5571102 5081510 9058130 7965806 8566699 63921355 377724775 57606825 341883575 46860255 6601090 53317485 7216640 54013595 67025255 67478935 5079052 58056945 6636850 5523536 3932705 343205575 6138274 66218975 62174385 5027946 58864555 352492525 44398985 5886302 Anserine_C13-label-2 36168716 15075214 28341016 44124547 25771355 45674366 37233041 31629588 29511459 19385338 25971825 30772756 27363006 53028844 65777819 36676516 53255094 27164244 60586819 45862412 38208728 33934347 30818347 40992659 50323609 53897931 39349166 16689788 34742809 6848355 28069709 25142867 238815 44999625 21834062 42199341 14809503 30188191 34352591 27140509 34326388 9007653 13207488 36258666 40716488 38966425 30739262 1222086 20794645 16141905 22935425 Arginine_C12 PARENT 153643762 3711208 151976862 85669219 272866975 1267979 285450975 111743262 161117438 234420675 196027062 46843955 196546162 84088356 202815962 17628305 307245525 300311475 55264644 78927981 94594569 116758888 293786725 109746338 174161812 88228731 3012259 8473470 11590665 65021855 337911075 3971956 147207462 114535925 282013675 321534275 233840625 8405649 54688865 146647662 345149925 347628575 388197075 366149225 5144038 3995542 342416675 377953425 3687122 364657075 54961655 Arginine_C13-label-1 9888804 24630925 10112891 5406121 1706823 8723282 19265902 6658619 0 15152644 12871055 31087853 12961075 4762931 12237606 11326121 1981212 19896117 3743939 4738632 5585518 7123175 19024144 6602474 10981716 5695466 19954888 57453606 9159281 43301375 22661545 27116628 1058449 7305895 18884767 2055555 15616208 56018256 36506538 9278138 23721138 23397969 27413416 24930342 34227856 27605478 23579538 2593137 24131552 25196039 36560612 Arginino-succinate_C12 PARENT 17596 752751 94762 467592 1032536 237044 29305 701435 1023718 2364306 429213 1010767 984477 652715 930623 1048393 1125186 2405103 468302 1932757 1242764 1153184 839717 118278 1564776 563524 893557 2730166 597544 237194 1237584 584926 993348 228402 112593 416899 51487 3452715 1097316 17226 1180887 901937 1075645 240053 1372463 637541 367985 1321215 90386 1392257 1363045 Arginino-succinate_C13-label-1 0 0 68645 0 77939 54688 0 8475 78251 294554 0 72035 17071 64211 69189 78122 69559 373782 0 210126 72383 189647 141451 107282 28139 0 79409 375197 111105 242482 154345 0 58631 0 69907 0 69693 246187 84934 0 99065 149821 74991 0 88145 65081 0 88535 0 238459 8707 Arginino-succinate_C13-label-2 0 0 0 0 0 0 54861 0 0 67297 0 69376 0 67077 0 0 0 84729 122019 64398 6151 69834 61798 53328 62263 62155 0 0 0 0 0 0 0 0 0 0 0 0 0 0 73424 0 0 0 0 0 0 0 0 0 0 Asparagine_C12 PARENT 18814942 17636988 27307016 26289466 22461611 22210369 20818105 28536728 24851783 24207267 21839773 23795562 3004865 29138412 25936639 271717 26605384 28672062 29289044 25202538 32193084 34116922 19887794 30320297 35001472 30353478 17869081 1838567 17976558 14972936 24517742 21502623 19077317 24360042 24245212 21099206 21987792 24860925 20634289 18389139 1891568 22323381 23256683 23717788 22179836 21887405 13814742 21734294 2051425 20999342 21192256 Asparagine_C13-label-1 1003983 1096266 1511365 1304932 1201776 1240287 950153 1236337 1481902 1279704 1224958 1160158 1480071 1471608 1276468 1357146 1254954 1320795 1653137 1355718 1467258 1758854 965445 1578456 1817511 140657 943133 111804 110993 72725 1307592 1188442 1186357 1296932 1094064 1104083 1098808 1450316 104306 958215 1127375 1257719 897833 111143 1239321 933929 82015 1315137 1055402 978252 1035071 Aspartate_C12 PARENT 13243366 8403009 33144403 14028562 16166538 1508393 13599223 12938665 22450077 22409481 12808124 12151181 21233598 15498892 13417191 15042078 15883323 28144775 19509155 12989644 27034281 35504284 22264839 11616484 26018208 21430838 14862206 1757112 21242056 11842404 23441583 1153349 20213742 7975109 16905183 7444434 27703616 19603964 16714952 13678998 1271405 2654895 18736923 20806256 20741711 14333633 10090882 24361236 30213012 21533238 20511698 Aspartate_C13-label-1 1181171 718637 2465575 1069681 1118607 1382188 1074211 1180685 1367027 1641818 908083 1401013 189808 1414247 1077112 108153 1096464 2357624 1552754 858502 2013611 2758961 165166 996244 1882142 152687 1180131 1032645 4227875 71982 2069359 835588 1442707 672454 111648 434449 2783921 1055822 838668 936368 1208563 2074184 1450411 1372035 1396457 1144787 703245 1578539 1773242 1397443 1376099 Aspartate_C13-label-3 0 64219 150338 68647 5268 6516 0 0 60541 76092 0 80224 0 0 0 0 72867 0 82241 0 0 121812 55365 0 59229 83891 0 0 455263 49703 92568 0 0 0 0 0 0 63618 0 0 0 67099 0 69413 65573 70509 0 58047 0 60133 0 ATP_C12 PARENT 18186425 11623045 12471279 14860511 1820685 35162278 3127295 18588123 10242365 16337533 1544467 2231624 29946272 31025547 35350475 37560178 32175047 23311525 26896422 24564398 45012675 25480245 17153973 30070622 29080953 26660691 13693717 13272077 7666085 18727877 12868648 15299973 184027 10414297 30731834 2724529 2305553 19196295 18048002 21963606 20898967 1558555 13675867 23486989 11136716 13139142 15288089 13130612 12239709 10458554 20441914 ATP_C13-label-1 2303921 1374264 1611638 1767284 2303909 4088921 360105 217568 1177609 1921166 1973474 216319 3825143 3595299 3645307 4200804 3777504 2988418 3250091 2821528 5080708 3025471 2149652 3335505 3641038 3352267 1577405 1596598 831361 2318999 1411752 1947808 2019227 1262912 3655848 233336 2825471 2164481 2281208 2762299 2539033 167486 1583905 2884708 1458448 1465441 1929174 1254528 1533658 1328945 2282695 ATP_C13-label-2 610173 495061 44218 504606 549167 120652 112045 546535 242855 55835 353878 0 993264 976436 1285148 1167156 991817 638343 938145 773505 1424627 87831 622379 79041 988024 844351 4992 489829 110238 407311 523915 438176 663475 389365 1017805 74148 733423 541409 47446 733947 769805 555523 458342 68805 405441 435625 391853 359999 312934 308893 668413 ATP_C13-label-3 0 0 0 0 0 86075 0 0 0 57138 0 0 81005 94821 0 157584 0 76052 54949 59375 101037 57141 0 74802 70857 74008 0 0 0 74751 0 0 61529 61414 65257 0 0 0 0 83633 0 0 0 0 0 0 0 0 0 0 61677 Carnitine_C12 PARENT 35391980 42139572 59439068 42651772 37235580 34735076 37911436 36881268 42634964 40443588 32535182 39416492 39853184 38173956 35256964 37209164 27383840 38700372 42296676 37548340 49221252 53203072 36507668 42179840 50440988 44011344 41883276 42306732 54035312 38714444 41594996 40453888 44496608 28434222 40973888 26521440 27195042 40506128 44941148 40062312 42754944 53947284 51025708 48351600 42554964 41384412 40521116 44819924 45973056 37159948 34801428 Carnitine_C13-label-1 2700732 325837375 4580288 327409275 286507925 265425575 2908756 285126125 325312575 310178975 246524475 301742175 302039125 292510025 269704475 271614675 208282938 292496525 317608475 278733875 3853956 4042238 2787520 311667125 380820125 332059625 318446725 325012125 4142872 295324125 327530275 3114782 342705625 215553175 306112475 2047806 206682088 306394375 3440462 310954775 3363470 404713925 402811925 368400725 332484625 3159277 3140481 342706475 3415494 283192175 265332875 Carnitine_C13-label-2 5269593 669147 8994473 5917771 4698144 5379112 5292728 5429924 706047 6644198 5148324 5798226 531875 5656036 4945923 5318071 3635124 5793147 6362935 5185596 750171 7702015 547163 5236566 7563886 6585317 6432821 6654316 7776705 5086878 6240884 61146 6488879 4093691 6262904 4437155 3818115 7005644 6035573 5394514 6493482 8329343 7357868 6848132 6224729 5921783 6402359 7394062 477485 5562206 5142602 Carnosine_C12 PARENT 20147456 7870796 11588693 27861344 12039728 30966266 22976210 28003258 12960829 10447683 11191059 15900671 14872468 35431668 48023116 35215620 35173568 27280744 41787836 19526246 18719622 17542840 15084557 44988532 32976672 39437340 26055890 11191048 13125661 9558085 28748246 35161828 15549191 42226084 16186757 39401796 36295316 14335912 17519642 36009088 23378298 13069507 10719384 30308888 33604412 21259078 12200677 16555448 10686156 11152112 15059699 Carnosine_C13-label-1 19761915 77764281 113785338 281479125 120902088 3107317 232047625 278225775 12687675 1042525 114801712 157312762 150205662 354605075 47565195 3514365 337871725 267899175 4257499 194467938 1886539 17572795 15170935 45348645 3257466 3915652 261609825 113762388 128038788 97112531 286414075 3549796 159288062 4230620 159088462 3979099 359095325 1440229 174337638 3614958 2309032 12903135 106390262 3077808 340203725 203336912 121153938 170006562 103368619 10861905 147612562 Carnosine_C13-label-2 300806 810304 1612081 3402813 762511 3393932 3314739 3608288 1845588 1585293 1331521 2767048 189841 5816332 5764588 1306512 3566949 2937415 6330316 2945748 2285951 2185335 2320919 1420523 4808123 6023888 4668118 625522 3819366 1013781 3701046 673473 2906437 2013687 2352823 5804925 4692458 178925 1778274 6656118 159127 71477 1483446 302506 625174 1812726 2134017 699922 1138488 1234192 216907 CDP-choline_C12 PARENT 5922028 3266284 4973201 4931484 6797563 4519402 4198634 4475134 4881943 5817721 4043109 4943932 3733278 6867177 4463954 7325499 5378816 4307629 655927 108177 6365217 4873669 4360219 581151 6565369 6184909 4634807 5377216 13525144 4395666 4564488 424307 3961005 5597928 45024 560147 3957994 6699507 6592412 3981427 4205541 34793 2664519 3273618 4115183 4401811 265977 4125647 3745445 5476321 5491044 CDP-choline_C13-label-1 861112 547181 905429 657638 1033197 613714 631458 742353 772837 78876 726813 828514 615149 107222 605127 1045016 830189 722156 1034634 1743379 968259 726785 652379 1060051 104971 1006244 835258 774383 199241 749376 837464 5705 363606 813916 735139 84342 526224 90732 1006859 667079 675525 530667 498265 481683 538504 718624 29814 754743 666065 604267 927904 CDP-choline_C13-label-10 59297 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 CDP-choline_C13-label-2 209521 59425 0 73367 122856 61079 92244 83795 83757 99042 171716 139421 6514 209269 89781 200509 11322 10895 83367 342134 114353 88978 95018 157903 186409 137017 62854 81875 523064 77625 21374 167589 57264 94249 63102 90279 89999 167519 263312 155936 14991 67417 65918 0 67385 0 0 76057 68218 79344 87046 CDP-ethanolamine_C12 PARENT 1270467 1039748 1093978 558698 1810632 884571 8103 474718 1263709 1051812 1106355 1089692 1164761 1398564 42354 1105316 885436 1323629 1606967 1270014 1662092 1750769 1237463 904515 1106542 776826 1018801 2019286 1428325 1834091 1423829 1204757 1813259 1227966 972774 1460277 1248574 194284 1940497 138245 1414353 1171918 113311 1091122 1241562 1595503 1151211 1176561 1234864 2053493 2136891 CDP-ethanolamine_C13-label-1 97715 0 95618 0 87677 0 0 0 112973 0 105819 0 0 100629 0 94555 0 76447 31564 73674 79322 169642 93168 102187 0 68887 0 224907 73566 115699 122911 0 108129 231098 95534 0 83807 273431 1167 0 109764 0 0 0 0 125674 82881 132007 144866 124658 189914 CDP-ethanolamine_C13-label-2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 75487 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 Choline_+Hac_C12 PARENT 2627312 3062162 16714886 3921614 4113222 3824389 5277804 3653221 3849057 3039462 14386702 2841571 2717015 3733464 3240422 8585305 4020704 2740144 4674383 5840827 13061269 4254025 6135098 2718477 2883538 2860427 4354825 405969 6304864 5280075 309269 4365254 2269438 3675968 6201536 78793381 4922433 2610678 5963273 362151 3621982 4642243 6961959 2488017 6440547 431792 3969538 3328871 341508 3963944 3990783 Choline_+Hac_C13-label-1 19115 107835 1108131 221298 247733 243007 17688 323868 375208 24404 1101327 104656 333009 259768 160527 582231 307784 326984 458129 293321 816815 276157 586721 161853 119347 201084 350771 214484 328514 3841 197635 423721 181539 275699 409107 5620664 29698 215306 442104 334515 163286 359144 50612 2438 385336 240434 320181 19184 330197 156285 348992 Citrulline_C12 PARENT 29939609 23660267 55786875 46376934 34272878 36828684 36862266 59057725 44682025 48000475 26928297 35430125 59504231 59755138 59962238 68157456 56044544 73905381 61554706 36802897 45680503 48065072 36060325 42425778 52903419 45390912 33110116 504957 75392619 35115938 65156306 5773395 40537541 52354722 43795541 48578791 51320459 47938634 39767509 51127166 51433962 51459428 66136531 5373925 59930975 51789725 50157259 40467991 64084875 4833975 47556016 Citrulline_C13-label-1 2667868 2412533 5902285 4724206 4153353 3536535 3953318 5365458 425137 4447148 2999574 4087892 6717778 4863355 6860717 6525828 439372 7741106 6091151 3788171 4676124 6281772 4077546 4353513 5495243 5153653 3016384 6013166 8821119 3904181 6363275 5623892 4572625 4787928 5185599 4529658 5241253 4604492 4048579 5233675 5632764 6097562 7503379 5867028 6415509 5692583 5248181 4203679 6156397 50311 4884806 Citrulline_C13-label-2 395348 273505 591793 587113 620645 421337 595011 53229 341414 399972 470528 14519 1084519 320051 65555 447073 105638 1004055 652161 117658 500599 660022 596294 498661 68483 756308 452942 446905 478014 233176 282594 447239 614695 46743 451442 435825 437717 266916 370287 594972 758711 744746 868092 619718 559856 640614 740701 363873 493403 536211 294135 Citrulline_C13-label-3 58221 0 131026 104909 206332 72359 95938 0 75153 7537 57681 6621 189458 122098 154134 118311 0 103973 96701 0 144997 107411 76078 102147 151437 119156 62971 128763 68534 53207 61837 0 61953 72587 75729 69839 0 0 6116 57392 93917 88023 149957 97417 65314 134399 61177 62311 59549 108203 60591 Citrulline_C13-label-4 0 0 0 0 0 0 4965 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 CMP_C12 PARENT 228274 113951 25253 111939 644928 191156 88048 97834 136278 219267 334074 143253 289063 338807 70148 244997 121333 152725 32956 323763 299075 4645 390478 196145 246887 128388 297409 439769 436051 411228 242936 149227 393504 445738 15308 466061 220372 53141 323946 151873 164031 310541 304021 90056 13481 196559 27457 31572 205474 468938 185411 CMP_C13-label-1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 72076 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 Creatine_C12 PARENT 312559072 304047072 284118144 308057312 379767456 297755808 255237120 291836192 319915520 323560864 328342656 286095296 319907712 315241312 295731072 333463296 334743328 343186944 367244896 381346528 339957792 388150560 344492320 340407200 334923392 312723712 293824640 368086528 362622464 298066784 243232048 280625024 348382944 340203008 360945152 313773408 324846592 339874976 327562656 279407392 306923424 294781152 289064864 231646896 278220576 293862624 291801376 336024288 303882080 332003840 299028160 Creatine_C13-label-1 14046892 13678248 12618501 13575248 17017682 13332261 11346248 12951369 14247723 13902540 15118528 12898499 14123621 14334965 13256360 14824584 14788225 15532027 16570844 16165725 15087451 17214386 15318333 15088281 15189108 13907279 13236623 16444731 16358032 13231355 10765183 12522895 15044101 15236495 16145251 13875811 14752011 15743685 14629956 12351640 13743581 12860919 12734557 10505203 12451792 13245553 13002856 14825343 13560575 15130505 13532616 Creatine_C13-label-2 20272311 20167138 19135162 19815558 26151406 20761481 18534214 20028119 23606942 22009461 22816977 19879894 23403111 22760731 19847531 23622069 23507911 25415417 27420197 23810589 22576695 2541213 21374845 22059592 21158095 20182733 22294189 24760067 25705652 22014648 17297439 22248983 23321538 25735748 25908662 23122117 22988995 22497812 21956964 20451255 20328286 208990 21534369 17672762 19481012 20312758 21036325 24185256 19586669 24180417 21643656 Creatine phosphate_C12 PARENT 20233474 26910794 42375492 32742834 405286125 37126476 43186876 42151044 16246479 32222408 13613776 39656212 28877142 19870036 41607100 21664146 27106282 12482063 7036528 377429075 18755948 11130637 15593849 13347852 30954080 27021840 21035716 12893213 157307462 26830394 25999312 38124180 17065620 301691375 18278030 373120725 12335123 21224614 35643440 32905928 18694820 36768812 33084238 61899244 39558688 41165520 30123642 29503710 33717644 28212662 50590236 Creatine phosphate_C13-label-1 88794769 11853565 189679262 148481312 18196538 167015862 196346738 1884095 72361931 142912838 61427875 175323988 128700825 89862569 18291275 98959044 123368712 56716644 31581441 17021933 82713975 48343641 69338444 59605256 1364347 118826875 97791019 56521569 6335321 121957512 117733238 173786738 7720565 13040354 79345206 16649473 55012869 96984175 160851562 147990488 82446919 167741738 148457762 278681025 179631488 1856654 136806962 133619788 153140238 13467725 2254400 Creatinine_C12 PARENT 34055628 69131592 48363332 39240792 25761658 41898764 14365648 48777840 56346208 47800052 31436934 20527902 34682196 45038496 46682180 39400828 39995972 26128390 29723472 31932120 29062214 31410250 28213954 18418128 51532576 58850956 29021952 31087290 15299143 21052134 13567453 33794188 29433578 35094780 17354376 10912761 13261173 30792512 35491184 19083890 15153099 21374168 21106824 46342276 27867862 26076534 19939224 31390064 17597614 35259144 42270032 Creatinine_C13-label-1 146714362 309475525 2091764 171166762 112732762 185823538 63313944 215027025 248119575 209409288 13671565 9010195 152868012 195474538 20242365 17626135 1748175 111547362 130103838 137647112 1279147 136125888 12276185 79039856 228181625 257786325 129874612 137674062 67735975 91198775 59082606 149583162 130200062 153932438 753234 48537716 58291275 136039812 157580238 83915294 66494344 90514219 913149 201227138 122450212 114466638 87978819 13664905 76950469 1556636 1867178 Creatinine_C13-label-2 2652505 5397369 3494705 297464 2195733 3084804 1262677 3238258 4390998 344737 2274814 1691794 2338396 3454323 3209128 3092467 2848238 1760872 1940251 250489 2211207 2213673 1724114 1313346 3558882 4270031 181094 2447285 1355128 1623072 1073626 2389681 2193168 2663241 1452962 612168 1099558 2083464 2601759 1373727 1106541 183593 159853 3497218 2054946 1937803 1594735 2299949 1581632 2661481 3256474 Cystathionine_C12 PARENT 102171 96844 81786 15505 180974 197459 222348 108428 98758 91515 219331 183005 350045 423368 331187 308564 23628 347573 69946 74198 127308 95605 252147 124733 145546 7772 166755 110771 392584 119886 264457 315976 88903 122902 81225 74858 75733 439782 185419 87787 91818 91953 106508 96106 321812 157042 150542 314831 223427 343372 284525 Cytidine_C12 PARENT 3181628 2568952 3271499 3434983 2825907 2490411 2480958 3853508 2823826 2830344 2694983 3906365 4028011 3176156 2241887 1801302 3149174 2077808 4722223 4439101 4653092 5707273 2112208 4207573 4423617 3296121 187003 1203966 2361391 987295 3075556 1272595 2579468 2877648 2332729 2210234 2239577 2015821 1980285 299739 2517001 326021 273094 2757833 2997446 3147947 2661592 3154442 2363321 2659323 2433296 Cytosine_C12 PARENT 18771342 39480109 38815666 46191912 207341 20471755 19828911 52567238 37534459 37704134 20207188 35462775 30869141 375608 47503975 35027484 33881159 36774016 44181016 49656984 37225409 39925059 35250947 49965772 46287228 39441434 21544255 18106212 29459953 19504519 35062966 2295672 22635362 24288789 31362103 21892444 26961303 27235744 27628409 27396978 24774108 23166075 21211106 2027577 23016462 21343333 70941481 21466831 19870305 31132778 19806183 Cytosine_C13-label-1 805541 1649917 1820385 2247541 1123216 928593 82159 2112044 1933091 1454044 965722 1528484 1543176 1667643 204708 1645563 1489215 1713005 1956075 2095233 1535556 1941969 1704211 2062188 1940004 1716233 912042 755978 1386633 901917 1724524 944509 932082 1040597 1337882 1081756 1359385 1161935 136801 1162502 1035773 876778 1005214 951768 1082997 945543 2640997 1215629 870094 1363154 996801 Deoxycarnitine_C12 PARENT 254004675 261561425 237916675 229971775 3314977 234879975 1711239 232930075 221005875 283562575 302550625 223809575 1832001 178125538 222184725 232417475 2078397 253272225 234016825 173402038 2829382 2866440 225925825 21833615 3116598 271221825 261053625 319496675 284916125 249117075 27530255 24219345 2857778 272036325 215548325 22019965 20004405 2978552 3582942 320765325 271478125 3439094 3311598 293961175 283621125 315266425 2981999 345056375 2803578 335601475 275508025 Deoxycarnitine_C13-label-1 18347617 1985535 18713938 17102839 24386742 1762597 12766374 17767889 16737127 21267177 23334473 17305839 13595253 13598995 15966205 1756533 15886489 19454538 17863642 13610395 22591275 20960311 16463806 15825906 2253348 20336977 20222242 25147645 2220475 19621145 20872748 18462942 21506055 19654531 17146652 16599905 15073127 22183436 27931216 24433806 2051373 25967852 24145523 21727262 22111227 23582188 22314733 25540342 20965456 26410169 20632995 Deoxycarnitine_C13-label-2 4593 57676 604068 518329 84303 508071 467971 534545 524704 775824 635529 508953 365303 451372 541329 378943 440787 261418 585864 282924 609205 623567 490152 541817 722479 672035 538261 727835 684391 705118 673741 413399 686354 590702 396687 31068 450061 647007 699967 56522 596299 708561 554575 580609 641067 535367 564618 706222 673533 717785 63949 Deoxycytidine_C12 PARENT 146267 3282355 2923801 3636702 1793863 1585164 1768248 4754445 2966132 2785882 1434013 2867386 2437627 3038534 3745414 2882551 277348 3173697 3709189 4015779 272436 3329606 2919123 4129643 3835632 3340246 1732483 1377429 2700204 1785099 3050763 227524 1820239 1806769 249382 1944396 2137992 2237437 257322 2333852 2184193 213668 1589555 1891588 2094859 1905962 5662925 1959907 1368543 288291 2092719 Deoxycytidine_C13-label-1 0 201294 0 0 104253 0 74788 388573 218566 0 0 209627 0 0 37667 0 68155 158289 100587 49741 0 0 0 0 0 0 0 0 62022 0 0 0 97271 0 88907 1005 91252 0 0 10098 0 0 143999 277994 0 89479 542323 0 0 177364 0 Deoxycytidine_C13-label-2 0 0 0 0 0 0 0 0 0 0 0 0 0 6638 0 0 0 0 59934 129449 0 0 73755 0 0 0 0 0 0 65422 0 0 0 0 0 80068 0 57632 0 0 0 0 0 0 57984 0 71251 0 0 0 0 Diethanolamine_C12 PARENT 17788905 19316725 26347616 2553333 25942512 25730105 25558264 22199894 30179003 17536195 18155023 38708875 20904862 29385978 32222178 188477 22577327 27389478 46866462 34114622 27165141 28763547 23322562 28219328 24983933 36959534 23644355 14815055 2465405 18011677 31819422 25367417 16640695 30128434 20418102 36131725 24136269 16840581 24400277 14794572 21991236 20070192 18819892 16320559 18392252 16701223 1924635 21340048 18966212 17798658 23364855 Diethanolamine_C13-label-1 859534 370195 1549598 1187508 1341463 1353925 1025322 1088083 1311605 872586 612958 15858 1100152 1302253 1423327 977041 543508 1484307 2223967 1732505 1204193 1295367 131229 1530283 886867 1559602 1455566 38725 618982 784516 1069726 1502307 705657 1253035 923672 1730477 1199209 118564 998012 887461 771857 1224125 522919 761474 101328 489776 763551 535831 414944 799017 883303 Dimethyl-arginine_C12 PARENT 37551747 87355106 40503747 30756919 586532 31634078 31310666 405121 49179734 81434019 31171697 81921144 66368219 36655725 47378028 57474231 5208015 96430644 27612541 34078009 34525416 34379162 60051394 33670741 52442544 27598106 55217625 91691956 34418103 68994781 37569897 53204181 38065559 28024441 48155612 21822277 294012 99624431 48032028 20739664 40935903 40906328 40888159 44071634 626252 4888785 45897041 39356366 40770562 40619416 75849919 Dimethyl-arginine_C13-label-1 3209005 7544416 3382293 2690608 4764586 2807497 2812378 342682 4010553 7193666 2634317 6831266 5741114 2748106 3877135 4631906 4494981 7962509 2457632 3010934 3007772 3369904 5568509 3128089 4052306 2197238 4607736 7174529 3229448 554902 3242581 410772 2949977 2397263 4221297 176114 2534995 8624288 395096 1709138 3414889 3264621 3367956 3804446 5412918 4001519 3545339 3214827 3381598 3595975 6127694 Glutamate_C12 PARENT 170255638 1656054 351813575 188545862 409794325 261829075 203880988 1738684 2441026 2546763 3455340 145951862 295780525 1313737 81011625 95046825 121751888 225515325 184868688 2394810 48587475 243356625 264209775 114527625 308610975 158578138 206736062 310096675 1507996 281684175 3549345 207526412 332864475 97921094 44466595 94350869 1519648 358758925 332310725 187297238 187571138 3320235 326229475 2840564 3560360 218843825 121969938 2781742 6153728 3286216 177550738 Glutamate_C13-label-1 1789058 15831564 32746375 182856 35286959 22845864 18111583 17357531 20541333 22394169 32408475 15553873 30098072 14084923 7752891 9600277 10163706 20211458 16692858 19346262 38263334 21767364 226486 10193659 27792166 14055944 18834475 26022227 25650375 21375212 34685312 16372244 23786988 9637424 33165734 9087257 14235498 26847506 25125788 15253955 18374052 29752816 27519159 22748638 29302966 182987 12659235 20366583 47999491 26421881 13739767 Glutamate_C13-label-2 655461 460362 9238806 6786705 1158406 7885579 705997 6195486 6152625 6355918 9442957 7089697 8639335 5730054 2752604 3096212 2373052 6953586 4992695 4873062 6051152 7796767 5564091 3773273 7439151 4605834 4894916 6949594 123250 3679325 12846069 3634898 6513894 4384617 5126081 3837976 440265 390723 409852 5656135 91833 1064781 11238673 5098153 6991464 4612734 6742693 5238102 9097306 5551405 3921118 Glutamate_C13-label-3 850043 777042 1418432 943764 1468412 732723 1385398 756963 826097 736245 1464914 1186023 1332013 741319 217875 625294 220808 910834 74603 852471 1619313 1226278 895717 632724 1019545 478106 794782 825599 2789575 635743 2280306 630347 946009 864196 1115926 490048 913501 625447 1139178 741744 1692199 1666744 1472058 946292 941118 430746 1015107 788982 127566 84175 86449 Glutamate_C13-label-4 92276 0 0 0 64456 0 80874 0 67742 0 64643 0 85862 142916 0 9082 0 0 0 0 86347 145615 76914 164634 0 0 148909 14911 46698 0 13233 0 0 0 0 197937 0 0 0 98306 34954 67074 113784 155753 172432 0 103643 0 143914 68011 0 Glutamine_C12 PARENT 10851819 55992055 20373362 13203648 15040608 12279497 11154647 16543899 16665844 19014410 12735133 8753493 18874656 13901115 13178748 14025552 15077581 20866046 15529359 13687229 18788494 17571222 10474958 14743197 19859384 16436719 12420909 14625204 12241004 10123709 9320437 9087542 10209441 8944089 10636227 80584655 82922055 13003523 11912088 9195779 13386947 13508297 15426597 10072464 11967827 9968417 11510471 11102307 12223396 9744729 10275317 Glutamine_C13-label-1 1192988 595326 207849812 139366488 1485770 1273881 121246988 153627838 153482862 1807543 1317969 90880569 202974138 141219262 116667825 144176938 1117294 191262538 15315605 1277457 18000605 180877638 10325385 1396025 180161488 162036062 124225038 1225843 133426888 83217819 81456269 84234381 92264781 76535531 898492 68755525 7054935 107074962 94842444 84679544 12035155 1239422 1421517 85024956 111311438 86857994 10615505 875562 101132956 83720994 833382 Glutamine_C13-label-2 54401875 25643889 81451356 55990919 6799035 56387344 55103906 515668 53844106 61265794 60131725 34970378 101598169 61861012 34985153 54897175 30521688 73561581 68331494 45541191 63171825 81883069 44286891 54854619 56375394 58790369 46084259 36547784 4576805 21347983 26024142 23238267 29442359 237579 27146034 22964236 20690089 27504797 24873108 31499962 40746359 4017445 44539288 27365728 34127297 26030783 39843766 27295372 30639478 28073709 24372467 Glutamine_C13-label-3 13605039 6325908 1900667 13691355 16947475 15151198 14050181 1051875 13585545 14082558 15645816 9168626 26845503 155958 8464553 13591708 7789812 19285964 20921212 10365085 16496441 22395758 12291121 13816305 14244998 16330502 11344587 1060555 12715631 5879724 6628101 5536346 7911035 6590131 736427 5208087 5285334 727545 6590016 8145826 11484263 9285975 10880401 7066138 9412628 6165356 8343609 7300526 8956359 7231144 7354748 Glutamine_C13-label-4 534992 614675 858184 681893 65528 551922 504242 614947 493489 634051 627842 77409 86802 754535 550275 703094 160365 903952 824704 452977 544827 580493 401026 89955 86617 898616 491121 352652 1421631 208141 357083 497512 326128 442756 314788 155764 182882 346458 305852 425572 416496 729554 49617 469548 588023 341025 534542 165085 199998 202704 160677 Glutathione_C12 PARENT 10567395 109607025 122528212 119797838 98221481 112285588 1822856 141151912 114368525 1251081 105183712 42939734 112651462 113810962 107278812 134496338 112315212 128431438 12498305 12915575 136366312 137309662 86755419 99351719 125830162 105834162 96600344 126379212 84972669 10032245 109488062 110990962 14918995 1052297 86872631 2425767 92864231 92230519 98775231 127221288 107217562 122142438 110115475 118266925 1218400 85754256 104601425 96469656 108506912 119932688 1026030 Glutathione_C13-label-2 1437632 1930333 1810319 187844 1458312 1812974 0 1866594 1675321 1833551 1382347 634429 1231373 1429563 1729594 1716125 1214754 1718898 2350169 2083771 2134456 210579 1383415 140214 1787585 1994756 1261779 1515934 1217293 1347238 1711322 1219568 1949524 880217 1483536 91572 1451513 828877 124129 1624469 1435222 1542271 1666211 2086404 138823 114043 1326914 1448933 1514572 1426123 870819 Glutathione_C13-label-3 177996 100927 14175 177683 134368 2656 76645 134739 137741 13443 200962 120294 21962 155544 11741 140659 175344 152357 194472 176456 223449 135206 116952 150905 240016 16511 139312 182706 140762 106488 172969 205671 144631 104303 158963 108097 0 197263 129989 184421 203558 138036 9583 169448 193688 113213 166823 110991 114708 9339 116368 Glutathione_C13-label-1 12047243 11918141 13568223 14198236 10777666 1267223 671489 1536613 1304269 14360311 1187743 4268804 12799756 13046952 12490185 14512486 12268273 13427517 1436615 14066519 1493892 13715573 899609 10912416 13100279 11263109 10970581 13522641 8880785 10545216 11773391 12680505 16155927 11576076 9408778 890597 10360838 10064538 10887341 13538808 1099173 12909677 11078616 13612117 13122184 9127035 11966627 10581278 12108663 12518079 1055751 Glycerol 3-phosphate_C12 PARENT 15489915 84994075 106994425 12461465 190139062 149425962 119644425 1594952 1797525 1574346 154692588 102514931 94915169 1314327 160560462 173682338 155586862 146821512 88117669 1470681 144027462 181225162 91726919 137995825 1935520 141457512 152873762 156246138 23163856 122251662 109959712 105534988 184908038 87478906 121594625 82156081 76230081 164087688 14115405 1613507 215414575 136288738 126613962 101601531 13459165 10532035 126589388 1481114 128754988 14841065 131632362 Glycerol 3-phosphate_C13-label-1 6749902 3542132 5690945 5594308 7216893 7041916 4885409 747897 7556383 7064361 6134372 5902488 3866903 5453082 6017611 6083235 5478423 5852677 3860457 5971267 5471264 7039636 3915108 5051106 7185028 5745954 6745945 5656581 1217558 4447676 4649761 3961384 6803228 3026334 4184603 2582477 2857985 5417481 4895891 6012963 7880316 5349181 4659511 3940605 5610518 4170891 4787542 5551809 4382036 5462541 4758774 Glycerol 3-phosphate_C13-label-2 772329 575887 1436791 954758 778234 1737368 397138 850737 1182623 1566085 54664 1762033 216506 593316 83704 103772 154475 221616 296649 62206 498215 542421 266201 98651 579056 23858 825609 256938 219273 54866 502727 5814 147681 0 6225 73596 69567 63282 6791 117016 300814 484677 104568 273918 467286 78272 431132 131942 115242 217371 0 Glycerol 3-phosphate_C13-label-3 2410197 1996614 4304559 3150245 3504791 6810458 1583207 2773717 4796161 4870681 255338 6474225 1550293 2334106 1626864 1031053 1054062 2194427 1901209 2740994 3007669 232514 140951 1304751 2696563 1900824 3234851 1419815 3006167 766674 4582144 1658584 2715486 1468771 1150287 1459996 1279424 1134528 961384 4508817 4564289 3341557 295436 3412325 4466841 1906977 8070913 2977383 2064148 2094844 953146 Glycerophosphocholine_C12 PARENT 161265312 99358856 177938038 1682272 163121988 9924995 130914475 24916185 190590462 179545238 1445666 1231954 167920612 176210788 81611225 215413425 12135145 11908625 1466465 176869388 215000025 225456975 89684925 143437162 178038438 134229138 104560244 1453511 97807869 150011588 140122438 89506425 98510425 141398038 10123875 117066312 90329319 1362004 116750188 99634325 15186645 13423905 1610177 102342131 111707162 12417425 126690412 153262588 133715362 13209865 186168712 Glycerophosphocholine_C13-label-1 13969642 8852443 1548825 14916233 146872 8472326 11312851 20328327 16437869 15514175 12889173 10905759 15205855 14268692 6741881 19162838 10137619 10142993 12080757 15608455 1906542 19996367 8035168 12201998 15226236 11491312 9165544 12713446 8502285 12906054 12704047 7644252 8603502 12988141 8669943 10169276 7327062 11501399 1001768 8150215 13372055 11743474 13812095 8291835 974826 10858902 1140803 13975294 1150758 10584515 16251739 Glycerophosphocholine_C13-label-2 319057 166873 98283 562652 325213 378186 190274 22841 165139 331358 226394 29105 220888 222965 229373 81022 486062 342599 432567 24928 23008 242578 463728 333809 434753 55996 195019 66146 273435 93168 450796 244763 347436 249419 476397 314066 210351 422817 250848 75361 234069 275792 79063 307662 337642 576434 236625 208455 351859 270529 341767 Glycerophosphocholine_C13-label-3 289256 1830 338979 442374 351197 19753 196164 392718 354032 342391 321478 413324 302071 377085 303812 268096 190759 105796 540592 533755 689628 620008 114161 338944 517572 334181 106642 283984 97751 188299 636132 113803 229994 258024 430713 151275 1091 17592 188596 273091 368074 242117 487957 445481 165367 186376 255792 25271 118346 144362 22918 Glycine_C12 PARENT 64767531 87829425 136060038 163077962 84474756 82997006 65575312 17022545 1445047 127147062 70986731 144802862 86368675 85258831 64288781 57989544 64787275 63592669 146755388 69364744 112497375 157281938 62569075 94492125 127694888 89793806 53341038 54683506 437665 44769978 55601931 70526369 97032644 159056362 100706675 144787862 153151462 61614531 49369634 127022712 86796194 101007144 82978531 80045181 53648831 60556281 10600165 592177 67253619 53756944 68840781 Glycine_C13-label-1 1536772 2213865 3456848 3592958 2256699 2076806 1768669 3935714 3274787 3092324 1814455 3787405 2238082 2353376 1523999 1511607 1636614 1455207 3712934 1924509 2674624 4163753 1526029 2303938 2861157 2090892 1337831 1149607 944057 1253825 1393646 1804667 1856482 3757223 2056294 347391 37372 1527048 1192574 2976293 2213594 2146537 2084667 1834829 1178025 1614182 2442319 1445361 1401974 1358464 1777595 Glycine_C13-label-2 87023 187448 93977 156398 72452 98165 69454 170614 66541 77237 76005 221003 70758 95056 0 76043 60209 84862 163576 56445 68802 86899 7163 140628 92815 154954 76111 0 0 84183 0 0 112358 93204 85803 0 138342 87555 0 73506 82696 98233 0 88884 0 80332 91627 0 0 0 0 GMP_C12 PARENT 286912 71773 0 0 1415346 13521 0 67855 72698 151279 97189 0 107398 2226 0 189742 494898 104614 791452 1201446 386815 377155 343412 478531 0 0 0 339263 2565584 129325 80485 0 912139 1897036 749461 1339513 203714 485503 0 6472 147997 0 0 0 0 0 0 0 0 0 0 GMP_C13-label-1 324294 828897 985484 912608 7677 46932 922083 1598677 364062 887896 245612 701915 61581 306767 851763 299616 405554 540148 0 58561 381676 379876 339793 174573 650871 604109 438246 379887 261576 854569 1066931 1811246 210485 284314 375696 149124 411918 259928 1396932 1158258 611782 131724 1253239 1900434 1151967 1427749 621571 62304 175178 1159604 1651374 Guanidineacetic acid_C12 PARENT 2004222 2852524 2887683 2401335 1951433 2013207 2255046 3993374 2395118 2275083 2209094 3604809 2089593 1884326 124224 1630328 1377973 1663921 228622 2346847 2155114 2273981 1311666 2543955 3666435 2812292 2983412 2173499 592984 4047936 2406321 2397462 1713865 2728966 2436143 2453105 2282771 5801234 2139398 3597686 3775531 282041 2399797 4386117 2671695 4224661 2991872 1525227 1893912 2150451 2149054 Guanine_C12 PARENT 213777 29578712 20199839 10307085 6023622 2040225 3282192 215209 11819121 11113105 3766717 764458 7344713 7245977 17010614 10185194 5534986 6541381 5837328 6735524 566962 13104069 11629612 14473305 5112891 9982788 1940106 4047487 12685241 5345367 7249218 3847883 2296318 7170724 7406492 5522996 3696552 5067636 6848213 13145425 2245573 4698812 4777032 2077844 2170857 2505642 9110475 3223479 4099717 22854875 3806397 Guanine_C13-label-1 179939 177458 1035666 570788 419508 138481 107547 125865 598162 475508 122936 329169 524003 491996 912416 595418 156005 289475 325563 470259 337845 719018 589007 874589 308278 540064 64986 265449 708839 403275 391508 106883 245285 477467 42358 326821 229544 348339 347983 64106 1181569 288111 259253 79315 64629 105407 4724695 177669 80508 1311479 176646 Guanine_C13-label-5 4919 0 54452 0 0 0 0 0 0 0 0 0 0 83757 0 0 0 0 0 73115 54416 0 0 0 0 0 0 46395 0 0 0 44036 6766 0 49222 0 0 91045 0 0 0 0 0 0 0 0 44843 0 0 0 0 Guanosine_C12 PARENT 715906 227061 796051 551154 674099 309557 210984 367248 707436 499718 489255 318836 1049562 774823 438159 375319 649888 641106 314069 1267774 773509 858967 246961 1303226 574825 351924 122632 300634 381516 18942 206416 133368 278172 463554 391092 230084 238816 295426 460047 345604 394879 437169 192263 204398 186631 348325 519746 401711 33599 524766 193052 Histamine_C12 PARENT 55401585 3368464 7877970 6148352 45682405 5326348 414522475 67520845 10155220 53046605 7411522 355134875 9172143 8909320 43026695 9108336 58638275 62677055 55930175 11261416 76672515 14013019 67455825 10431377 6315648 42754695 4060640 60106345 63686425 4616355 3865969 3550370 45751095 49739095 55340065 388112325 259663125 5032264 51291915 3029995 3690306 7326500 4672672 4833658 3414294 51425745 13686657 6936612 48665075 5010369 10554861 Histamine_C13-label-1 31165803 19254217 43481434 33498544 25116889 29412719 23405488 37134634 55987694 31616231 42003309 19207108 50443484 50189034 233544 49824725 320578 349762 3138125 6102225 43433578 7865675 37828309 57496831 35203403 23405762 23486723 33217934 35937278 24645867 21023408 18138562 25769088 26411284 30608128 21653931 145705 27999775 28730428 17101708 20138789 40357703 26378291 26871966 19362442 28691488 75880856 38325875 25985125 27594878 56720569 Histamine_C13-label-2 645575 422282 971339 735148 510229 689067 672312 806785 1164435 601072 1002353 530283 1082115 113687 449638 1178785 761037 744859 766719 1290049 84828 1707934 934848 1377483 51985 54596 532204 707812 682194 6106 337406 293379 549189 521046 68439 549521 401229 757888 63945 42364 4257 859649 35438 722285 379874 572649 1593755 869286 538176 566339 1164805 Hypotaurine_C12 PARENT 23484177 11143395 20752244 19814144 24285633 21724281 21664088 24078936 12563579 20514977 27465391 55661681 2171528 20242969 9809962 12379069 8477744 19600894 20527811 11486559 2051965 24368175 15251939 863229 16850245 13337658 24437508 17000864 18866327 18084923 41902734 3140295 18542752 27855719 11175991 244923 14115862 18730962 13659181 51606528 20649144 26021714 21019423 72490081 40754175 89005856 13854986 3335635 42989825 37918966 29437503 Hypotaurine_C13-label-1 448725 2419824 0 0 0 367868 1620 458855 0 0 0 74002 435199 316335 0 0 0 0 0 0 0 0 527768 0 0 0 0 0 0 0 505918 27006 0 0 0 561709 0 653886 0 455915 0 0 236178 1670801 324025 707091 0 351081 5364 496523 0 Hypoxanthine_C12 PARENT 71514031 19577717 7967941 11718179 57384294 25548195 23078736 15153669 14660252 24886592 303550 14716866 34290919 16403845 9141438 317684 23730375 30270488 65968119 1529826 40112966 45599366 2172017 493914 8285088 18428105 15755105 27804259 607710 2354412 53831819 12705335 17466609 67945406 17710008 78185675 15466809 18428375 11617509 24043742 52378197 21261442 13592508 11725284 21467281 30385534 19020498 13321395 8952434 16043439 1239698 Hypoxanthine_C13-label-1 393468 923421 216032 623957 3167562 1422377 1166836 707549 989786 1413194 1343762 806099 1959828 1005972 197323 1789224 1373814 140975 3341715 8419962 2132171 2570741 1267423 2352681 436811 1021129 86943 1441876 3382268 1214373 31252 646659 1026697 3558072 847862 4327134 877771 906147 520146 1340942 2700612 1066758 686815 425487 1175553 1791089 1032804 649858 407903 640498 250132 IMP_C12 PARENT 46443497 18354567 923969 8789053 2534132 18817055 4539387 15399555 1835453 26411612 31163797 4822612 21565006 77900519 6321352 48282116 80685419 21762808 314551575 395684675 93481019 106352775 98057806 115063462 1290691 6131075 14161523 56919481 52212305 41891788 16253561 6007921 2086247 340115575 11341505 294046075 32137003 67200506 8398247 1758508 29574578 14205745 16564373 2088199 317316 11074485 14550231 6155066 7111402 5829896 4289914 IMP_C13-label-1 4715846 1998062 6844 1139198 26817588 2016508 365542 1855531 2100708 3216853 3178333 718057 2247927 7972473 662684 5329462 9232305 2517477 34486009 42807597 9539781 10764088 953106 1302079 1260169 556734 1507624 5787609 5664815 4576022 1917565 81824 21320695 364048 11296434 31874016 3143287 655554 973339 2097158 3223689 1680199 2048675 107998 20449 1059145 1901379 547822 655193 675903 593224 IMP_C13-label-2 717118 167964 0 77419 5026828 223908 0 328161 372945 375635 637376 0 460098 147867 83421 1109123 145529 497815 5950869 7367603 1954445 2027822 1795847 2047423 240266 91908 141024 699485 10030994 566572 434991 0 3678558 6785362 2116883 5402321 5866 882771 114019 19578 513356 233697 153023 0 0 0 302146 138854 0 0 0 IMP_C13-label-3 0 77293 0 0 514229 0 0 0 0 0 63031 0 0 69628 0 68586 63689 0 683608 532538 59668 86661 0 178993 0 0 0 0 1095989 0 0 0 154762 42761 91899 659906 0 89129 0 0 0 0 0 0 0 0 0 0 0 0 0 IMP_C13-label-4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 98187 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 Inosine_C12 PARENT 634776 14997561 6320574 10585776 40094916 21347777 6714023 16954892 21870358 19497783 17267177 5958511 22145864 17222906 8752882 22396977 23462423 14383286 32806709 125386262 18616588 24384375 138975 23696269 10285716 10229584 7974612 16682319 56929475 11121565 1364677 8160156 12398552 55987225 8953806 4111425 5613178 17030073 7791152 848406 14825831 1385193 8236945 8961402 8064265 15599761 6083789 7904895 6663324 9381546 10922816 Inosine_C13-label-1 7343398 1673697 589476 1151279 4154703 2393299 836579 2166655 225518 2108931 1949282 793972 2126922 1816606 944951 2682212 2436943 1789254 3790986 13340052 1856268 2664871 1636789 248022 1010897 1110177 974098 1604604 5728232 1135899 1307169 782229 1316604 6024414 104494 4354634 719058 1808538 894513 924876 17893 1247934 1047529 973359 88065 169437 654418 948758 71275 1149842 1172264 Inosine_C13-label-4 0 0 0 0 0 0 0 0 0 0 0 0 0 55952 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 Isoleucine_C13-label-1 3504629 2614016 4625114 4404989 55002 4039226 4155193 3916573 4184222 3788265 3951525 3990637 5161131 4410542 4069764 3938504 4698542 5070418 7393903 6291753 7404205 826452 5612911 5809609 5043377 5307482 2870136 4435514 7789717 4407739 4704838 3608572 5528713 4489481 2533846 4735482 4548255 5100488 4541808 4219441 4405506 4778162 4429366 3669381 5061094 3587577 2902017 4973416 4098107 4232574 35528 Isoleucine_C13-label-2 64941 80711 13733 84663 197663 208691 9599 86507 77338 92996 79416 98518 131172 270981 97715 86396 93345 106621 123085 126511 24014 360642 165104 10884 86696 102673 74251 189191 161453 83659 108387 81417 84506 65779 99748 150972 106955 79083 93557 87469 111352 95924 136775 75109 18401 0 0 77879 9619 92589 67903 Isoleucine_C12 PARENT 49657628 39651772 70682175 62683619 8456635 61662331 57966888 54761956 59390038 54243606 6221825 61163925 78050969 65306406 58938544 59797256 70771469 69418394 104104575 97480219 112535762 119095362 7582025 82847231 73923575 78092456 46485634 69332831 116167062 68935094 68285756 55549744 78852625 66656544 97923481 64318681 6714315 79096094 70759075 63457631 69149681 72605106 67585488 49128612 731164 53626125 44954947 74217025 66123175 66342306 59358869 Kynurenine_C12 PARENT 41016 613437 565766 712922 577549 578988 92301 718972 620243 805836 377023 455672 557375 880696 628959 933296 578655 449962 67426 50041 597047 85717 560277 399512 669223 725607 401739 535835 680206 394741 365757 350262 531379 415248 363894 207594 442025 589793 503237 278829 26183 241777 433577 454099 450776 564145 42212 501699 513258 547674 490468 Leucine_C12 PARENT 100768531 81614531 1500719 1399432 148631212 124305725 100478956 130240825 133393612 119934762 122867662 119659462 1636995 147524288 1365843 128213412 16100445 145461138 203538212 174859988 223570525 226220525 144902638 1677649 172478688 165932388 945891 1382899 280666475 1284706 132275338 2366896 144281612 141494838 166753038 115083388 117564438 149597288 148705612 118375512 1295187 128202262 128379112 103964281 137605088 105335712 8393945 147790388 121215162 127158762 128408188 Leucine_C13-label-1 707886 5379618 9611123 9738059 10280893 8648921 6922225 8826329 8715353 8296024 8402365 8345095 11334797 10124188 9469624 8704862 10461866 9062869 13014484 11925185 15515258 15468523 1014982 12492104 11791691 11546927 6505466 9528652 19262536 8935691 8685687 15117581 10402337 9130571 10972909 740557 7776673 9879259 10065704 7916029 9116275 87652 8543759 7218174 938787 6898731 5644612 10111362 8336478 8783403 888149 Lysine_C12 PARENT 127611138 47579265 149419262 89012756 2619978 11023155 136872538 125408688 178386338 309081575 123553188 67588645 337005575 128624625 2913626 295864175 355071975 7984634 63023369 144047812 109458538 106347988 3283144 173329762 268983275 10014505 291165475 6751764 3161423 50258375 166299838 392993575 134917738 112048712 305909525 99728756 131113888 8024664 313422125 63468069 225811475 151242538 176675212 159357588 359440125 21437785 18475155 16577805 15306285 1485962 354168875 Lysine_C13-label-1 878841 32780225 9976688 6269664 17083178 7138497 9380684 8778504 1114938 2036983 835831 46755228 22346839 8610515 19623583 2031555 24279794 5496965 4500493 9835752 731451 7322805 22634652 11671379 17997498 7030685 18449381 45405334 21466744 34043484 10455675 26330716 9388607 7418803 1925558 6470561 840607 55369256 21235936 4108364 15395069 9766056 1249322 10447241 23871092 142598 12404885 10796785 9620291 9364821 24209952 Lysine_C13-label-2 324895 810071 211942 174569 490548 266717 104734 205936 301253 565107 188331 1135244 516906 315537 499376 442104 603851 1028952 97998 235156 205728 138933 517092 350423 44279 122717 597269 962943 644009 695676 240156 672166 138335 195932 437748 175188 174748 1228071 510292 113847 328209 230401 264392 144709 421763 381875 226217 258247 281375 17703 541362 Methionine_C12 PARENT 24967648 26054461 31522203 30349328 30003703 29488572 275065 31241462 37699988 28936397 32740931 38621134 43274891 35919175 48962338 50799012 533357 43815575 50652209 50984659 56592781 66377456 35816891 62388731 5628395 51819809 25026238 30639191 41070125 26985359 31296759 23838912 35040088 35075966 46353375 2896865 356914 42908597 42459909 29078203 32189841 42142309 38931772 39388822 34308716 37871175 250387 40821941 28652153 31943775 38231928 Methionine_C13-label-1 1566158 1868928 1712695 174878 1915436 170784 1670088 196997 2134758 1818468 1876559 2318092 2304564 205803 2339753 3034554 2970337 2679684 3337268 2636163 3314131 3985611 2143556 349277 3579357 3194534 1698727 1760049 2196349 1624691 1797809 1438765 1898922 1934454 25213 1510466 2051159 2524815 2440238 1921066 2163412 2419451 2150649 2192759 2261746 2208106 1527067 2497477 1852533 1966783 2338975 Methionine_C13-label-2 0 0 0 0 0 62052 0 0 0 0 0 0 0 0 0 0 0 0 0 0 66507 83234 0 0 84214 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 Methionine sulfoxide_C12 PARENT 100486 124345 2453794 2134029 1264305 745771 1327705 2278725 267541 2843175 1026229 2057114 1556136 1300787 1877703 2513132 1976858 2452035 1867439 1571254 1191007 1566857 1438097 2792114 2575367 2533496 110955 1086155 1496008 1060013 946313 1091336 76621 98554 1225079 1258334 1124925 926591 1313255 869811 1820931 1437339 1304319 1595697 1521355 1845532 1175759 1265933 836245 561761 889492 Methyl-histidine_C12 PARENT 13062854 6435734 21127573 29664759 10919382 18846775 1485673 36756175 17033311 14673692 8869345 20409412 22363989 34065228 34012597 29306512 27715859 34731978 35397778 24402389 23255795 22927681 9818662 37171575 40523347 35578728 14018492 7074635 4117696 5440223 12177109 11648406 8293679 10860862 10431016 10515588 10522715 7662118 716355 7617916 10023485 6063994 9137946 11828872 16047512 13668845 6158625 8900281 7643113 8706208 10063422 Methyl-histidine_C13-label-1 902176 488515 1686893 232143 792174 140412 955156 2920462 115238 1040651 73192 1742853 1661187 2635185 2387861 2432273 2105567 270198 2586256 189948 1806579 1786696 69455 2740316 3057796 2813336 1126071 539162 412846 405944 850565 78424 616041 639166 726436 922221 852728 477862 594781 66485 753545 567288 717769 1015201 1140787 94162 553302 586066 504007 518988 779206 NAD_C12 PARENT 66952525 68499206 79886856 83556919 7938175 74881369 68286244 8326675 86805106 84188225 7059115 81617281 84155131 789012 877984 8201175 86446781 75959744 73201794 79131606 87580256 73562281 69309069 77792381 89145925 79053075 64137288 74483531 55748375 6785155 67753756 73440131 73978125 65857719 686325 75222094 6618455 8268895 82515369 79025981 75322119 7315965 81607869 77027906 65102819 68971781 56709481 73004669 81760031 78856325 88406381 NAD_C13-label-1 16079317 17287525 20476975 20364275 18258219 19140502 17213098 20431794 18673758 20650808 17291806 19369367 20091712 19201658 20237264 19976561 19622438 195440 17726555 19302942 21723906 20868527 16443106 19736506 22098192 17852462 1604572 17522527 154224 15541961 16665164 18598112 18338242 1589908 16602388 17723173 17123191 21157567 2065652 19623686 17991917 18008464 20320492 18700483 16638161 17337511 1444852 17721619 19881244 19026092 21775245 NAD_C13-label-14 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 78998 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 93833 0 NAD_C13-label-2 3715725 39015 4954861 4127127 4408449 4202252 4258918 5310336 4636989 4309836 3860071 4853716 4616917 446627 5039236 4511955 4447382 4314736 3762537 4121732 471013 4252925 3741968 4129992 5181652 4694936 3472503 4123386 3142043 3729708 3938212 4228535 3787074 3761417 4345029 4025317 330547 4839762 4149775 4381271 4345988 4301819 4489361 4449962 3651378 4154626 3209331 4129868 4677502 4377546 5024061 NAD_C13-label-3 570778 699178 829821 792403 734779 775397 584104 670203 769879 730613 745512 861993 869134 803097 555038 778939 751282 710842 730444 639938 815451 934292 63121 810957 958767 714353 528403 755816 588326 64978 750465 677684 678964 83635 779494 590264 632084 795812 787291 690943 729704 878932 737166 727219 626198 523352 708215 765487 72567 43309 861864 NAD_C13-label-4 72713 0 162665 88583 84074 71642 62257 0 0 67755 0 104484 135909 70705 69748 64595 0 0 62945 99551 62324 156143 0 0 0 0 63311 88084 0 72039 69793 0 0 0 85659 0 65547 0 0 60213 0 107741 6717 82613 0 0 0 6621 63615 0 79814 NAD_C13-label-5 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 8685 71581 0 0 0 0 0 0 0 73168 0 0 0 0 0 0 99002 0 0 0 0 NAD_C13-label-8 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 Nicotinamide_C12 PARENT 234708825 183276588 117915312 213993475 42206425 24085465 128530562 129033838 2283486 86823669 4995766 978067 4589416 58356245 2218849 211465325 376525025 4256726 19581138 6243520 73522565 8305336 6022864 303932025 297022525 309355725 3077994 1729200 83623775 229624125 259847125 18382945 61564665 44271375 49456495 411012675 4723314 258656175 1713144 241443775 202899138 176590838 228189375 723612 97625331 107016975 211076125 17367625 149529262 1483388 169786288 Nicotinamide_C13-label-1 15625145 11700894 7877756 12897013 27594572 14364764 8602966 7961532 14684539 5581955 31357403 5634727 284908 376837 15148962 13642195 25554262 30563478 128705712 42037725 47947509 55905325 41199753 17949695 19694495 20214011 20808233 9848891 51229875 15058473 17041369 12729779 39487759 28099716 31873384 25867173 316655 16391914 11640471 16204086 11775679 11297612 15582823 5196403 5921089 6391181 14014486 11349568 8888975 9307149 10826109 Nicotinamide_C13-label-2 336957 125867 0 365983 860738 235697 170123 169135 191069 0 839434 0 636116 1023863 371452 144896 703877 606039 4105159 984609 147022 1103143 1033894 359954 403604 461867 35341 203292 1386349 582892 340452 146782 1041227 535169 723795 35436 906614 181789 177875 175949 181263 37516 276044 0 96551 0 205831 21465 21112 0 277388 N-Methyl-L-glutamate_C12 PARENT 721033 261356 174908 699161 325402 829192 545879 773276 160779 182743 207606 264646 175696 827837 1320539 825984 907907 998386 1054853 349602 314079 174384 148094 1171285 692198 957433 1038326 222107 142884 244627 101339 1414108 184221 1168993 168624 1122074 1594902 197376 171454 925684 977276 168174 140806 4532 68429 220358 291184 160224 407333 142573 250368 O-Phosphorylethanolamine_C12 PARENT 17007848 14014433 13607811 13674234 1949025 15601411 7647177 13680033 19326381 1786137 19056683 7514516 15031944 19180973 10215259 17448969 15845708 17258439 22130458 24044138 23134438 25671545 17612092 17121681 2059925 183620 15828508 16147514 20666138 12000384 22767544 13873181 24389095 2036285 14804106 9582105 12922681 17414847 15472262 13731381 16092623 13501239 13688889 13893186 13280928 16703739 14386255 17985564 15096939 17837069 19012598 O-Phosphorylethanolamine_C13-label-1 336861 280177 141424 460758 420747 29998 108215 363965 535075 509818 549542 171775 415055 481246 337598 398955 416613 357314 461298 60627 569528 698613 281935 41481 302976 532561 205503 370896 517899 341269 544236 317268 648535 49971 33336 255398 284424 313775 307894 358546 407611 374351 144787 18897 161338 257588 308036 490561 300763 390675 575254 Ophthalmate_C12 PARENT 63481 330756 799056 246721 573709 1114301 593769 706268 723351 843962 834661 52332 1240094 330631 379797 218682 833076 1247125 298075 73476 966249 509275 841716 679162 920654 383284 1111133 501083 194769 500469 752302 116336 227483 125478 925464 0 98668 442918 971376 206003 731665 51763 61716 201078 166965 214174 467819 519593 479877 283054 491034 Ornithine_C12 PARENT 2795762 5208157 4281428 2422704 4045706 3152169 3267262 3247726 3131745 3310882 3218888 1201526 468763 3103347 4034598 3486494 4440479 8051596 2959511 3173381 3031459 3525847 6377975 3663031 2933963 329508 3197806 5356101 8078516 5224748 5094756 10194566 3470745 3409759 5347309 4483286 3732925 5042104 4475466 342493 4062357 3106895 4430723 8507315 4210829 7394106 4225896 4367549 4761661 4092086 4095543 Phenylacetaldehyde_C12 PARENT 4313101 5889788 14257805 9798451 614513 12688575 5399905 35290634 6712241 8221715 1169139 9301531 8072796 8524866 19102967 7064293 792233 6522801 15977497 12937152 949176 13020723 7244925 7919513 7679621 7519362 3503677 5731693 5540586 4518861 6678195 6174524 6963183 6147238 5552466 12753503 7327103 48666 7534499 5050106 5923444 377266 14784558 6862229 9665871 9157481 6226686 69051 7138252 28941666 8694351 Phenylacetaldehyde_C13-label-1 498036 661602 1339445 671493 562474 1138274 549894 3022149 591602 675158 967745 871377 725706 733863 1598615 625795 768748 548826 1360452 1161617 847323 1138316 800515 587387 706489 601845 30949 505279 476524 423428 51611 402812 679779 548787 401836 943529 588038 283172 62629 40472 49143 368109 1208751 584699 854501 1013128 48084 615529 660888 2380269 800716 Phenylacetaldehyde_C13-label-8 698034 655086 879469 803267 861903 807081 1170865 747053 805696 1380516 699569 954917 729063 685073 743675 847777 78416 741968 820128 2054976 1164189 1082123 791149 713377 977411 101824 696635 905686 846862 773679 1082187 1208187 564198 780438 916758 886379 108575 1005699 1033891 705528 889047 1041742 556903 103032 1044635 965019 601543 929525 1087203 810509 901425 Phenylalanine_C12 PARENT 87778544 71728131 12291325 13579535 106063075 102966519 77315775 131599062 125555088 113903238 93977669 11406625 122271038 122973338 13537425 139132262 148768712 120552612 171692888 1758002 171839138 1615400 103957219 170578212 179601538 147210538 82612281 103583169 130640338 95146119 11397415 164982412 10326065 111145812 127009388 9674005 103746481 11778095 116533388 94988781 99389669 115428262 113190662 101036594 109867262 105553638 8918785 123356338 99108075 100631181 125635125 Phenylalanine_C13-label-1 8883647 7628936 12432516 1360563 9974398 9917412 8157399 13178125 12629012 11583041 9412102 10484573 12573795 12010222 13563072 13758936 154807 12324659 16750384 17197255 16426694 15106789 1040335 16625433 17322609 14227212 8127712 10225901 13159459 8911071 11217256 16691812 9962378 1097518 13484998 9825441 10282941 12341377 11711484 874932 9342782 1136394 11086221 989179 11403329 1033413 9081846 1184134 9722069 10310052 12563685 Phenylalanine_C13-label-2 223393 192076 449235 371455 244297 294461 332664 373334 474711 507698 229234 305092 491798 392082 43407 414784 447217 388042 701429 638854 479964 517106 376378 798266 777949 435197 26045 440301 511038 496527 365614 572243 342419 249386 588937 269232 31688 409592 385664 228115 34387 20715 305406 340428 405139 26704 286991 426617 241315 255624 431742 Phosphocholine_C12 PARENT 72014344 717225 791367 98561075 58912481 7570785 14796023 117970625 8530285 1076787 52746256 1733457 57132194 842485 77398744 10409115 69542519 53948956 62868581 6745195 65537906 557648 39801266 39866766 92054519 86723356 60603944 4956005 52100275 16319394 10632805 39821441 62692156 79526656 20594589 17649767 6020449 49201591 37680278 18974748 14504055 10029403 9033713 46953775 36281309 208537 27571297 33284797 7420462 29868478 34177384 Phosphocholine_C13-label-1 36858 3888213 4229915 4955731 2762374 4047694 903521 6026186 5121536 568874 2993283 969243 3350104 4451157 3885603 5224505 3498755 2914787 3175847 3690618 3943086 2924038 2338613 2042279 4872272 4680605 2604872 2693691 2702108 1015678 529719 2261636 3237891 4242239 889106 931051 432808 2403536 2012086 954231 838364 462201 55742 2287343 1861535 993257 1417475 1877572 494845 1681583 181799 Proline_C12 PARENT 208445362 221987425 214856575 196169188 232275225 256019875 238881175 2026671 1962317 190746038 237419475 19928005 2431126 2675914 177113338 2084322 218546075 177708012 227359875 234675475 255443775 2860143 220531375 250617075 2070045 22412275 183466938 15577835 212990925 143874312 233981075 212705375 185355062 222098575 248958875 229753225 2146220 2236700 205407888 1834724 1419476 221801175 2017158 227024925 2046558 213570925 149517138 223514025 203283762 218185675 210871525 Proline_C13-label-1 12245634 13053187 1222044 11388985 13648939 1438783 12554237 1194739 11338902 11563179 1386382 10344885 13978617 15668467 10062696 11902699 12627152 10149344 12451219 13167567 140024 16609217 11719704 13940083 11878579 12842059 10292835 9253847 12219121 8200623 13325427 1176251 1109012 12768865 14327625 12528302 10989654 1234392 11986948 10385952 8194793 12491254 11923207 12933746 11483385 12190877 7811248 11963727 11512009 12282298 1143769 Proline_C13-label-2 702516 839362 437395 62848 479655 651895 664234 59919 406954 464421 817686 768103 719988 716855 240491 442695 183781 20075 510264 297393 364653 767664 650041 311913 234195 49908 631128 131689 20825 0 352752 186074 135772 281155 72606 397696 254663 228714 150073 120406 177108 193215 330143 333009 298121 488439 162856 224803 180266 372966 37568 Pyridoxal_C12 PARENT 766954 677445 1117258 986232 756831 806942 410546 1311896 975372 713716 117627 252759 741063 831159 749824 649857 1073705 71384 636434 1140583 657156 1108612 632658 608375 182759 851359 635221 561855 361327 414643 1051332 643228 529773 372288 472182 317008 282911 562533 346511 474933 451233 846425 590116 972969 1152515 790619 610435 663458 922435 672776 879095 Pyridoxal_C13-label-1 0 0 83478 0 54363 0 0 91556 59164 0 102261 0 64435 62433 54436 80611 59323 0 57965 73613 0 61383 67115 60009 92219 65479 0 0 61285 0 0 0 64884 0 0 0 0 0 0 0 0 0 0 15571 59827 0 0 0 0 0 0 Pyridoxal_C13-label-6 0 0 0 0 61521 0 0 0 0 0 50956 0 0 0 0 0 0 0 0 0 0 0 0 0 47455 0 0 0 0 0 53531 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 S-Adenosyl-homocysteine_C12 PARENT 323085 198723 426264 542099 313475 358486 157689 577125 764441 418368 594607 322412 713601 396081 505328 531477 496758 747559 1704551 771509 1018714 1246935 380362 744059 65954 61628 308331 148278 264673 188814 106833 224821 353618 458997 265596 473813 22506 102139 80644 156919 10762 287971 281519 91435 150418 95897 224364 22537 0 106854 238721 S-Adenosyl-homocysteine_C13-label-1 0 0 0 0 0 0 0 0 82238 0 0 0 0 0 0 0 0 0 84436 0 8362 82111 70903 0 0 6488 0 0 0 0 0 0 0 0 0 0 0 0 0 65258 0 0 0 0 0 0 0 0 0 0 0 S-Adenosylmethionine_C12 PARENT 16879244 17963569 19506275 17304567 18468567 15931089 13566455 17584361 19364548 24440998 20331061 1476093 16872639 12872622 14873391 1855103 11363843 11527759 1311202 18640494 191110 22511336 13748495 13319739 16861752 13415442 16184173 20071895 985263 12912705 13813912 12756352 19861302 1121075 20331356 1264158 11751257 20564325 2487102 16917105 17638806 19274723 2285087 1411888 17700398 21224331 2216123 24634944 20660989 24559733 23547905 S-Adenosylmethionine_C13-label-1 2739798 2584975 276767 2895734 2858597 2440597 200644 2944608 3116432 3961132 3307116 2432305 2383464 2025465 2034255 2776237 1724586 1763796 2282123 3130487 3157237 34597 229468 2303554 2560345 2053424 2751892 3300154 1644009 2383642 2300588 1842081 3022784 1916725 3290684 185839 233817 3488129 3797892 2770846 2479234 3254684 3588191 1941949 289763 3116708 3494885 374902 3478923 3507565 3728445 S-Adenosylmethionine_C13-label-2 204185 23665 203251 212362 200928 180239 94706 189782 314749 267838 231246 217638 111973 198093 113907 14353 115487 250795 104947 191072 204628 154446 117806 8629 269157 91125 257881 173521 68205 101568 83265 0 284953 81954 320576 76649 86535 152635 118339 12194 24202 172147 267781 206371 213215 214499 108233 219213 2521 300184 254559 Serine_C12 PARENT 38047122 38199034 43745409 43590572 40227109 42997988 42353209 52197109 48335212 39458541 4106255 44642353 47963791 48169259 50878159 53787169 56618781 55916575 55785594 45437888 52427541 57962225 40168884 57654625 64034269 569823 40902291 42389303 53094106 33641497 44361603 47496488 38217525 53033631 4988485 50469509 48277253 49230284 45803497 39603609 44390016 47487303 4913565 52988756 41688625 45118475 38252491 418632 376563 35009741 42073175 Serine_C13-label-1 2015327 1644771 2314286 1780531 1813606 1956682 2095641 2117294 1830704 1607105 2032424 2219937 2257758 2049402 2179117 2462728 2175809 2369195 2625405 2077601 2334212 2733413 1741267 2552082 2635653 2655526 2100579 1614181 2040974 1396894 1835092 1916374 1198978 2222616 1968168 1931436 2221125 1754558 1765758 1729419 1879523 1927702 1873639 2267816 17564 2089112 1866282 1663591 1535124 1200389 1619215 Succinyl-CoA_C12 PARENT 15746 501321 185115 238495 0 179016 45886 205362 324044 172262 116302 320032 292087 192413 172068 139308 108412 172618 0 0 236717 83715 84625 101903 317028 262368 37026 129131 0 360565 516464 28602 286123 0 161606 0 154782 155399 370077 341451 147387 160267 330792 322561 376779 396618 563375 643102 294282 444556 483587 Succinyl-CoA_C13-label-1 0 8956 0 0 0 150715 108439 101477 152594 127789 9584 0 89573 8411 0 0 89188 0 0 0 10607 0 0 69797 124187 79057 114419 94035 0 0 0 0 96451 0 0 0 0 112169 0 80374 95726 119358 0 0 130074 193851 0 0 167301 120115 0 Taurine_C12 PARENT 109390120 97847656 97371968 106925592 113206424 104896224 112672000 102061704 65670844 107313632 107852344 123222696 106988808 96222008 107032904 107860232 109941608 111937528 111858144 117940472 108859320 106152024 108042808 126840168 106997800 102821632 110878304 119780536 123007656 125964792 121879784 114871688 107562176 105193824 131212200 103798760 121644392 116883192 114868008 122329984 122593216 131547968 122244760 103677800 127743512 129919168 127771480 120659688 124847608 113800024 117692928 Taurine_C13-label-1 24306105 219461275 218604675 239754775 2568170 2373330 2493229 231804925 1481740 238258225 243958925 2836930 2474023 216670525 240079375 250696275 243025275 2522341 247827925 267311825 242526075 243193575 24513185 289590475 2376283 235910925 2493945 269458075 27290495 282154625 2732950 25669525 243973175 236651975 291459575 23777745 274942325 267013825 254790875 277497675 273995525 296355925 283260725 235399775 2914593 284678125 2906068 26986935 2897677 2509961 269654825 Taurine_C13-label-2 85691 245949 0 162915 31262 137358 631057 306374 13335 43796 363337 138773 237492 112438 335742 206683 12293 326797 214158 440941 185827 41294 290657 313977 414965 300753 227867 62152 41443 304176 0 313193 368341 30408 702268 198012 583101 28558 367317 319854 263634 410354 200575 82908 12137 220913 351964 330896 98323 491052 23552 Thiamine pyrophosphate_C12 PARENT 113047 82369 102286 183264 189334 310122 0 99944 104469 213793 92612 0 180037 112012 186438 108944 219597 24515 120305 102633 289863 175668 181378 96312 259541 276361 277043 128951 115115 83452 95317 18512 208196 125478 8683 0 90169 169298 122558 107309 107031 168323 106463 115011 103043 183964 9772 80832 70941 103671 265096 Threonine_C12 PARENT 51619303 371724 61507081 55383988 55203294 63887031 56663788 65051869 58382431 50991225 522349 45497528 7030165 805103 873897 74141981 84902956 878465 79137625 60690981 77369506 80987569 59996875 86728881 89402531 80020544 50887278 58035312 107677412 44129884 68105331 79202475 47660625 64844788 6740425 5748845 59376844 68496406 57421462 45225441 58888056 6039575 66143375 50541116 61120169 46846341 43548084 58111881 49349659 49775834 53173531 Threonine_C13-label-1 2404313 152055 2468866 2263127 2419118 2925973 240681 292663 2580378 2643338 2140222 1851541 3034334 3657162 4093326 336338 3606318 402824 3499273 250872 3009639 3203939 275985 3432353 3707054 3420904 2123197 226021 4615126 1682308 3224893 3475917 2002045 2595449 3194826 2422392 2631536 2807309 2497514 1973851 2776984 2421017 3409165 2221481 240739 195658 1935833 2490266 2131417 2411843 2324833 Trimethylglycine (Betaine)_C12 PARENT 13672576 16237124 12727908 11034714 11307179 9950539 11215379 13093460 13813749 9849835 10742529 16353407 9594531 14252301 10494793 10441837 11906344 9989905 14364560 12222131 13468207 15449236 10938533 11593712 12380893 13524843 12155515 12904084 15725725 11709343 18059272 13738323 15088868 14051317 15430253 12863024 10410201 12391049 12003691 13049733 12324805 14277007 15137160 21049326 10817712 19351448 14549039 10458209 10727473 11575827 10833119 Trimethylglycine (Betaine)_C13-label-1 754830 912684 69459706 61278594 583896 55203075 61717281 72507156 77540206 52824881 59884056 90391444 51934312 789451 54581062 55228469 65471831 55709331 77898531 66245881 745811 859357 59041144 60576844 66839225 76261519 68777069 70931706 84355506 67615588 98699331 77384719 81804594 76655275 83198881 69344225 56681381 67513675 65294569 716371 670074 77498831 81604006 11752305 59947819 106000525 80080331 5578545 58012581 62577431 54411031 Trimethylglycine (Betaine)_C13-label-2 1881641 2059538 1642207 124329 1428361 1297159 1531396 1876858 152726 1255133 1361544 2054788 1335005 1754388 1571873 1427436 1411786 1150406 1775712 1352737 1833226 1664738 1479831 141308 1393013 1333191 1606426 1530583 2002475 1627711 2146196 1687971 2079668 1794367 1490642 1566699 1292726 1246001 1434487 1718743 1520633 1796273 1966774 2571982 1437566 2338653 1888154 1232823 1265657 1228288 1384536 Tryptophan_C12 PARENT 18216636 23937592 36509953 44854516 28072859 25478656 142530 48209428 53692631 38992041 25005955 35867116 28300059 26998328 37517625 32114841 30384484 29485247 36073075 52694569 48559409 43349534 23028075 35713725 49672812 381600 18335156 37080872 24659394 36814562 32254722 41640159 28885234 33527847 42329472 2969095 2502322 38357262 34789266 20452967 31282638 26893891 273093 32151347 28587184 39517003 26936334 25980562 29041753 31418659 48446853 Tryptophan_C13-label-1 2096297 2606522 4231232 5803207 3372572 3168422 1737624 5675394 6661639 4250795 3129882 4112286 3143269 3181866 4480971 3893668 384561 3390636 4267514 619375 5938739 4927633 3007245 39256 5991672 486169 2404381 4435416 2864964 4404481 368985 5101243 340168 3745823 5002969 3592347 2827811 4210273 4016908 2549648 3246528 3462304 3145535 3665247 3384075 4532794 3333192 3242684 3496513 3670281 5590459 Tryptophan_C13-label-2 63203 61757 97379 191139 155228 84873 64414 181652 269455 108277 59144 9372 64558 89579 107285 78701 100244 110162 8466 98319 208151 207836 77601 131581 90583 246824 8734 89459 64836 114147 12239 20392 171319 160003 7254 59657 61744 178926 92791 66671 107252 81227 72597 128796 86205 123036 118207 83815 79003 75661 180918 Tryptophan_C13-label-6 371048 19072 680071 1219778 39464 1228623 71726 1122752 411636 210556 395264 200254 456124 70384 2013755 821345 1148694 737301 578349 309344 345316 393304 394407 1040249 140269 1218747 748329 203857 250609 17547 896181 1091231 138421 558159 136169 71868 784873 585319 493622 1164044 776028 555635 290802 1610307 1935266 853897 157904 752694 322269 432342 794338 Tryptophan_C13-label-7 0 0 0 109322 0 127526 0 73517 64197 0 0 0 0 0 82045 6435 66888 0 0 0 61597 0 0 70052 159718 80995 65697 0 0 0 83885 0 0 65326 0 0 0 68078 0 64567 98683 0 53757 75957 279925 0 0 0 0 0 0 Tyrosine_C12 PARENT 27326547 5312655 45153597 475578 37490216 34537112 2796545 46230866 50935616 43202184 36617784 70512375 406845 40498466 56796912 4236875 50091384 49888391 54267481 59262475 66505231 58627706 34990491 60306119 67888419 57681394 29226928 43302678 637855 34908362 38202584 62882869 34073147 45174028 4773355 34937088 38444953 47651591 44332559 31534866 3379055 43025872 39545353 77991069 38919809 67194225 35158472 42924947 33159888 40255997 46133162 Tyrosine_C13-label-1 2642315 4823741 4443795 4586929 3893894 3406084 2977507 4746385 4692714 4009432 3447788 7532573 3981478 4031279 5321451 4056019 5053659 4803053 4746989 5679909 6620832 5747878 3353102 5829988 6136909 5517196 2850312 4338408 6214736 3720941 3885829 5981182 3475303 4479344 4503764 3188014 3658147 4809898 4192958 2758612 3202191 4235469 3847141 757393 3951114 6621688 3692718 3878058 3154421 3948014 4902309 Tyrosine_C13-label-2 54984 74729 82795 5786 83337 51494 7602 0 155535 0 80746 72386 73891 89452 96642 77079 79913 79298 146438 82536 83814 82875 58199 103222 82466 57952 10381 163336 98986 0 132131 102246 0 87625 7189 55755 80597 82348 87931 62664 130114 70717 65445 95571 92927 8078 0 90838 0 0 101635 UDP_C12 PARENT 25567 6896 118569 85915 456889 251937 98588 128754 174753 0 113626 86208 143631 256115 81038 383671 233583 161179 412386 786156 321865 267722 71194 368269 397559 107439 121693 110685 531214 111263 103693 0 205153 329849 392553 409362 0 206749 175672 138325 73982 198265 137048 19071 0 79577 92195 98106 171194 70658 111199 UDP_C13-label-4 0 0 0 0 0 0 0 0 0 0 0 78814 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 UDP_C13-label-6 0 0 0 55886 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 UDP_C13-label-9 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 62959 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 UDP-N-acetylglucosamine_C12 PARENT 737478 521315 692283 491348 52684 76862 48569 581332 466387 660543 411184 90371 966753 814108 476642 46586 484564 429747 804449 1057761 1150966 1101241 378994 500802 627319 683679 418134 450087 1185815 560256 1048177 477871 716454 51138 467521 462462 366406 586385 4969 425286 51425 495775 574402 657466 340062 400829 285543 456681 380433 461517 771788 UDP-N-acetylglucosamine_C13-label-1 72707 80666 183407 66394 73213 80262 84533 60737 52436 7048 70136 184321 18791 167208 0 139562 7384 0 10926 83153 15167 159126 61768 70897 98109 61436 0 0 194134 0 137483 0 113669 0 62961 0 0 0 58385 89803 0 77942 61896 77082 0 60215 70782 79183 0 0 74738 UDP-N-acetylglucosamine_C13-label-10 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 61818 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 UDP-N-acetylglucosamine_C13-label-16 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 584 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 UDP-N-acetylglucosamine_C13-label-2 0 0 0 0 0 0 0 0 0 0 0 6705 0 56751 58754 0 0 0 0 0 0 0 0 0 0 0 0 0 0 67267 100568 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 67316 UDP-N-acetylglucosamine_C13-label-4 0 0 0 0 0 0 0 0 0 0 0 0 56477 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 UMP_C12 PARENT 1073413 36249 540614 544237 1315294 836633 360644 756279 735239 482163 52082 470151 543442 412657 402715 599645 1362043 734351 2716456 1363425 1343432 951581 49972 966953 1244479 200483 618651 581525 7934905 494254 1266773 613724 1417789 1416471 911646 1223864 216732 624237 451859 633459 590733 98923 592126 660896 43937 551742 623788 761543 699625 455433 483955 UMP_C13-label-1 75098 0 0 0 83022 0 0 56181 60185 0 0 0 0 0 0 0 60288 0 240388 138927 126834 603 0 58302 54181 0 0 0 833453 0 76432 0 70776 76214 65124 149526 0 0 0 0 0 64884 0 0 0 0 61537 0 67165 0 0 UMP_C13-label-2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 139199 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 Uracil_C12 PARENT 199035 259047 418226 352319 309573 330535 397653 266989 339736 340718 253006 295415 307885 405299 396533 235975 349026 323557 382458 418728 251126 374418 257269 320623 38061 369254 270298 208564 203778 202449 333722 201928 297494 262704 118934 336312 189384 377591 159038 27122 254637 292452 281909 172926 279261 359853 349218 136215 223124 28424 288362 Uracil_C13-label-1 333319 446455 44634 493051 212094 471835 133393 501596 419018 265877 226041 248317 553431 312719 423628 33137 352452 290189 166625 293628 394209 217323 353759 143142 579912 512703 204926 453956 126806 141409 8954 35991 535941 457942 166262 131741 131059 427547 487689 291317 124703 247926 186215 5421 29712 19547 155035 198787 109807 16269 256857 Uridine_C12 PARENT 1195918 493572 8253 0 735479 192932 1582005 0 0 85661 54709 0 216293 61084 0 0 67469 70295 54347 6275 116141 64879 1659727 158896 87416 76653 1678862 1309249 1113199 973754 1133435 1646216 332505 892846 1424888 377306 705298 1367473 1671126 414246 1115875 1624811 485096 16094 1531034 30911 458552 106892 1591983 418298 203595 Uridine_C13-label-2 0 0 0 0 0 0 0 0 0 49717 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 Uridine_C13-label-1 103614 9017 54813 0 55914 0 98745 0 0 0 0 0 53149 0 0 0 0 0 0 0 0 0 178497 0 0 0 139157 81707 71914 6275 85094 176384 59875 61086 96503 0 0 146413 12393 0 75368 108484 0 160814 71209 0 53534 69032 99287 66197 0 Uridine_C13-label-3 287747 98329 0 134186 314489 167596 106381 110144 73738 0 199108 0 0 86483 58102 81968 51251 0 63431 0 0 79756 383639 0 0 0 17722 123405 416866 471101 584805 613467 117452 366044 309278 5394 362284 844393 31296 5701 844686 330527 252212 126814 127011 631375 114441 386863 820016 68086 381816 Urocanate_C12 PARENT 7014198 45055888 36627466 14028706 8262199 3045413 6352627 32205738 8090345 1541607 14234948 21587814 19613573 19508288 20086455 20558542 14589634 11360912 47951416 76835531 33081828 42651603 29216653 66358981 206012 46171609 10655373 14551014 51065878 17495692 11081898 15711358 9709587 32612034 363201 300571 17002423 102885 24095467 18574158 34506712 9553562 18884223 8543063 3900483 5139347 54837644 12888041 10040935 19521181 10310276 Urocanate_C13-label-1 605014 2635492 2325614 897961 75886 284584 523114 2015276 5655981 936545 1161417 1447008 1356997 1278553 1277173 1371478 1025488 752849 3070574 4876748 2247341 2844492 1466557 4580579 1407272 3251703 754269 1087595 3545553 118883 938202 1108305 99095 1985811 2654601 2191597 99241 790719 1828604 1380579 2172949 877192 1411712 637202 420447 420206 3932233 1162416 811154 1408116 988411 Urocanate_C13-label-2 0 78842 0 0 0 0 0 53358 81666 0 0 0 0 0 68042 0 0 0 74331 95153 0 85343 0 55324 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 57509 0 0 0 0 0 0 0 0 0 0 UTP_C12 PARENT 86774 65819 77282 142682 66549 296811 0 179101 53721 79957 60234 0 193595 192544 185048 218846 198731 65895 99446 330872 403601 225483 7336 304178 215578 174565 63638 120006 0 88801 62745 63924 95277 8935 9982 6214 8136 80424 100329 235823 90088 73729 66902 177244 78261 107926 74884 78487 70063 68489 114219 UTP_C13-label-1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 UTP_C13-label-6 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 60657 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 Valine_C12 PARENT 17584115 172479388 203238138 210734275 196941238 208654438 1798286 210921175 191852638 171813838 19878785 172303738 2264573 227858175 21786025 194686012 236247025 23273885 261573125 221377775 2486330 2731596 197732388 2318550 242876075 230553625 1618788 212164175 349629525 20002965 227674725 3279447 208038712 22394895 228734025 2041755 207390362 225936825 216692675 200237512 205580462 21344575 211053525 220873775 2328797 212820575 1841092 227927975 206198262 2118491 228244675 Valine_C13-label-1 9706602 9540422 11519562 11889435 10190294 1185023 10464735 1146466 106865 10373179 11424816 9503809 12274521 13054173 11466337 11103855 12484795 12996874 13870877 12639206 13818911 14902677 10582298 12045762 15100245 12306591 8685177 1163849 19588177 11760626 12155941 17723158 11635572 11223618 13045559 10535409 11895982 12081045 11181849 10663982 1132184 10719529 11871821 12402304 12297102 11316515 10396559 12556418 11489807 12515543 12841412 XMP_C12 PARENT 378738 0 0 0 1453541 2370 0 59541 168144 81596 219475 0 99824 38275 60636 24781 566293 102756 996459 1715234 378019 456131 506466 470587 0 63095 0 339734 3157265 16004 0 0 1043942 1848165 778914 173496 220698 405922 0 98751 103335 84583 81927 0 0 59629 0 0 0 0 0 XMP_C13-label-1 0 0 0 0 77811 0 0 0 0 0 0 0 0 0 0 0 0 0 79722 22067 0 0 70837 0 0 0 0 0 354211 0 0 0 8197 136881 0 90229 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 XMP_C13-label-4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 67356 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 Glucose 6-phosphate_C12 PARENT 108835588 12239485 70770331 82488744 5958455 1098241 76365269 81581944 78023675 1039332 82048825 67809144 71579325 123107762 120158912 162803138 116070912 61431144 89122331 2378343 107912938 109310338 72310894 67739869 9935195 9241075 99312781 136075388 54931 12628355 38563125 51281941 157661312 39158391 1345362 33812362 69778844 1436115 125321662 66612225 87938531 113191562 79597119 78613019 61540625 6866455 74083556 115885488 75260869 100803169 104856669 Glucose 6-phosphate_C13-label-1 7629997 9443869 6568696 6742641 427813 9156196 5517591 6224291 6155803 8981995 5777144 6223889 5782188 938016 8100355 11056085 7701707 4456291 6707906 1652653 7290037 738707 499388 4469568 7058922 627217 7080071 9650941 0 9116912 2982855 3700747 11142891 2861602 9351025 2541156 4952642 9447887 865066 4777731 6212639 8424405 5710298 6219286 4406001 4707343 5029421 8320396 5534812 727026 7027196 Glucose 6-phosphate_C13-label-2 561473 758003 1895138 584394 24739 1854154 154451 39945 502563 2295075 186612 205636 273043 433953 245514 97342 78784 200913 579354 16931 238996 159244 217001 72551 210262 222631 62018 65042 0 77257 282633 185888 201948 78831 126721 161368 0 58468 0 176053 97294 326624 7253 508327 257757 218127 426213 184534 0 134047 225216 Glucose 6-phosphate_C13-label-3 822116 2564331 267538 1784286 461977 3194484 680603 1003856 1504176 2687906 705237 3644364 742094 1616452 61012 565929 332726 399023 1253202 87635 1199059 706671 47106 245452 67486 714334 1277011 200893 60034 264721 793044 485748 906565 95777 724524 82919 638178 126822 426677 742687 724271 1136707 706936 172259 805145 749447 1793716 1109253 725757 621462 516726 Glucose 6-phosphate_C13-label-4 68568 95313 99709 84925 0 282664 0 72797 62295 205743 0 192718 64526 0 0 51949 0 59642 97263 0 49763 59234 0 0 87926 0 65808 0 0 64144 85645 0 0 71705 0 0 0 0 0 0 0 75077 0 77681 59491 0 7828 0 73983 0 0 Glucose 6-phosphate_C13-label-5 0 70159 168304 72002 0 172179 0 0 84159 7987 0 17146 0 0 0 0 0 52241 0 0 76547 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 12916 72057 0 0 5181 58275 0 165881 0 0 61267 0 Glucose 6-phosphate_C13-label-6 8403 157963 803807 479279 220538 2244031 86731 302643 578096 137638 159315 844884 428211 253815 326431 137932 390124 540993 298715 192311 304876 138888 79554 2645 16155 412416 347321 105385 220975 105467 979838 364926 376545 385951 420836 116095 77205 67125 225373 624516 722618 796688 73447 862671 1043405 362688 2414575 589577 32624 393129 81101 MS_METABOLITE_DATA_END #METABOLITES METABOLITES_START metabolite_name medMz medRt 2-Aminoadipic acid_C12 PARENT 162.075638 9.226 2-Aminoadipic acid_C13-label-1 163.078522 9.264 2-methylcitrate_C12 PARENT 207.050156 11.384 3 5-cAMP_C12 PARENT 330.058746 5.049 3 5-cAMP_C13-label-1 331.061615 5.084 3 5-cAMP_C13-label-8 338.087006 5.098 3-Cresotinic acid_C12 PARENT 153.054291 1.25 3-Cresotinic acid_C13-label-1 154.057709 1.281 4-Guanidinobutyrate_C12 PARENT 146.09198 6.808 4-Guanidinobutyrate_C13-label-1 147.095306 6.916 5-Deoxy-5-(methylthio)adenosine_C12 PARENT 298.095947 1.967 5-Deoxy-5-(methylthio)adenosine_C13-label-1 299.09967 1.969 Acetyl-arginine_C12 PARENT 217.129044 7.195 Acetyl-arginine_C13-label-1 218.132004 7.197 Acetyl-arginine_C13-label-6 223.148483 7.13 Acetylcholine_C12 PARENT 146.117188 3.275 Acetylcholine_C13-label-1 147.12059 3.257 Aconitate_C12 PARENT 175.024506 9.915 Aconitate_C13-label-1 176.027206 9.967 Adenine_C12 PARENT 136.061493 2.556 Adenine_C13-label-1 137.064865 2.558 Adenine_C13-label-3 139.07222 2.615 Adenosine_C12 PARENT 268.103394 2.7 Adenosine_C13-label-1 269.106628 2.7 Adenosine_C13-label-2 270.108856 2.701 ADP_C12 PARENT 428.035461 11.179 ADP_C13-label-1 429.039062 11.049 ADP_C13-label-2 430.040131 11.054 ADP_C13-label-3 431.044434 11.033 ADP-ribose_C12 PARENT 560.077209 9.75 ADP-ribose_C13-label-1 561.080139 9.747 ADP-ribose_C13-label-11 571.110535 9.667 ADP-ribose_C13-label-2 562.082153 9.754 Alanine_C12 PARENT 90.055199 6.63 Alanine_C13-label-1 91.058586 6.646 Alanine_C13-label-2 92.061958 6.661 Alanine_C13-label-3 93.065277 6.675 AMP_C12 PARENT 348.069519 9.817 AMP_C13-label-1 349.073151 9.807 AMP_C13-label-2 350.074249 9.812 AMP_C13-label-3 351.077484 9.792 AMP_C13-label-5 353.085938 9.787 Anserine_C12 PARENT 241.12886 8.864 Anserine_C13-label-1 242.131897 8.863 Anserine_C13-label-2 243.133942 8.872 Arginine_C12 PARENT 175.118484 10.519 Arginine_C13-label-1 176.121948 10.537 Arginino-succinate_C12 PARENT 291.128937 11.392 Arginino-succinate_C13-label-1 292.132233 11.405 Arginino-succinate_C13-label-2 293.134552 11.368 Asparagine_C12 PARENT 133.060532 7.898 Asparagine_C13-label-1 134.063431 7.885 Aspartate_C12 PARENT 134.044464 9.175 Aspartate_C13-label-1 135.047806 9.099 Aspartate_C13-label-3 137.054611 9.168 ATP_C12 PARENT 508.001892 12.736 ATP_C13-label-1 509.004913 12.632 ATP_C13-label-2 510.006012 12.645 ATP_C13-label-3 511.009857 12.651 Carnitine_C12 PARENT 162.111984 6.801 Carnitine_C13-label-1 163.11525 6.801 Carnitine_C13-label-2 164.118927 6.806 Carnosine_C12 PARENT 227.113281 8.962 Carnosine_C13-label-1 228.116501 8.961 Carnosine_C13-label-2 229.119003 8.972 CDP-choline_C12 PARENT 489.113312 10.195 CDP-choline_C13-label-1 490.116699 10.195 CDP-choline_C13-label-10 499.146851 10.224 CDP-choline_C13-label-2 491.118317 10.199 CDP-ethanolamine_C12 PARENT 447.066101 10.386 CDP-ethanolamine_C13-label-1 448.069794 10.396 CDP-ethanolamine_C13-label-2 449.071777 10.438 Choline_+Hac_C12 PARENT 164.127853 5.36 Choline_+Hac_C13-label-1 165.131149 5.355 Citrulline_C12 PARENT 176.102585 8.167 Citrulline_C13-label-1 177.105927 8.16 Citrulline_C13-label-2 178.109451 8.162 Citrulline_C13-label-3 179.112747 8.167 Citrulline_C13-label-4 180.116699 8.23 CMP_C12 PARENT 324.05838 10.412 CMP_C13-label-1 325.061584 10.493 Creatine_C12 PARENT 132.076462 6.602 Creatine_C13-label-1 133.07959 6.602 Creatine_C13-label-2 134.082993 6.601 Creatine phosphate_C12 PARENT 212.042557 10.406 Creatine phosphate_C13-label-1 213.045898 10.407 Creatinine_C12 PARENT 114.066208 2.86 Creatinine_C13-label-1 115.069458 2.833 Creatinine_C13-label-2 116.072655 2.888 Cystathionine_C12 PARENT 223.074326 10.242 Cytidine_C12 PARENT 244.092194 4.077 Cytosine_C12 PARENT 112.050644 3.239 Cytosine_C13-label-1 113.053886 3.22 Deoxycarnitine_C12 PARENT 146.117188 7.475 Deoxycarnitine_C13-label-1 147.120453 7.477 Deoxycarnitine_C13-label-2 148.123962 7.49 Deoxycytidine_C12 PARENT 228.097351 3.245 Deoxycytidine_C13-label-1 229.100998 3.254 Deoxycytidine_C13-label-2 230.102921 3.263 Diethanolamine_C12 PARENT 106.086388 5.528 Diethanolamine_C13-label-1 107.089775 5.527 Dimethyl-arginine_C12 PARENT 203.14975 9.48 Dimethyl-arginine_C13-label-1 204.153198 9.473 Glutamate_C12 PARENT 148.060028 8.922 Glutamate_C13-label-1 149.063446 8.921 Glutamate_C13-label-2 150.066635 8.929 Glutamate_C13-label-3 151.070038 8.919 Glutamate_C13-label-4 152.073242 8.981 Glutamine_C12 PARENT 147.076111 7.574 Glutamine_C13-label-1 148.079407 7.571 Glutamine_C13-label-2 149.082932 7.574 Glutamine_C13-label-3 150.08606 7.569 Glutamine_C13-label-4 151.089722 7.578 Glutathione_C12 PARENT 308.090027 9.03 Glutathione_C13-label-2 310.095612 8.969 Glutathione_C13-label-3 311.099518 9.031 Glutathione_C13-label-1 309.09375 9.02 Glycerol 3-phosphate_C12 PARENT 173.020523 9.912 Glycerol 3-phosphate_C13-label-1 174.023911 9.911 Glycerol 3-phosphate_C13-label-2 175.027893 9.916 Glycerol 3-phosphate_C13-label-3 176.030624 9.911 Glycerophosphocholine_C12 PARENT 258.109406 8.003 Glycerophosphocholine_C13-label-1 259.113464 8.019 Glycerophosphocholine_C13-label-2 260.114685 8.027 Glycerophosphocholine_C13-label-3 261.118927 8.023 Glycine_C12 PARENT 76.039764 7.193 Glycine_C13-label-1 77.043114 7.177 Glycine_C13-label-2 78.046509 7.199 GMP_C12 PARENT 364.06424 10.455 GMP_C13-label-1 365.071625 10.414 Guanidineacetic acid_C12 PARENT 118.061066 6.731 Guanine_C12 PARENT 152.05632 3.445 Guanine_C13-label-1 153.059616 3.453 Guanine_C13-label-5 157.072678 3.46 Guanosine_C12 PARENT 284.098175 4.299 Histamine_C12 PARENT 112.086922 6.279 Histamine_C13-label-1 113.090317 6.288 Histamine_C13-label-2 114.093361 6.295 Hypotaurine_C12 PARENT 110.027031 6.633 Hypotaurine_C13-label-1 111.030563 6.657 Hypoxanthine_C12 PARENT 137.045425 2.814 Hypoxanthine_C13-label-1 138.048798 2.826 IMP_C12 PARENT 349.053345 10.389 IMP_C13-label-1 350.056885 10.39 IMP_C13-label-2 351.058228 10.381 IMP_C13-label-3 352.061646 10.399 IMP_C13-label-4 353.065643 10.379 Inosine_C12 PARENT 269.087189 3.54 Inosine_C13-label-1 270.090851 3.546 Inosine_C13-label-4 273.101562 3.501 Isoleucine_C13-label-1 133.10498 4.554 Isoleucine_C13-label-2 134.108398 4.568 Isoleucine_C12 PARENT 132.101593 4.538 Kynurenine_C12 PARENT 209.091736 3.651 Leucine_C12 PARENT 132.101578 4.059 Leucine_C13-label-1 133.10498 4.139 Lysine_C12 PARENT 147.112366 11.236 Lysine_C13-label-1 148.115768 11.263 Lysine_C13-label-2 149.119293 11.217 Methionine_C12 PARENT 150.057999 4.742 Methionine_C13-label-1 151.061234 4.754 Methionine_C13-label-2 152.064667 4.722 Methionine sulfoxide_C12 PARENT 166.053467 7.471 Methyl-histidine_C12 PARENT 170.091934 7.963 Methyl-histidine_C13-label-1 171.095306 7.95 NAD_C12 PARENT 664.114502 9.915 NAD_C13-label-1 665.117249 9.908 NAD_C13-label-14 678.161865 9.936 NAD_C13-label-2 666.119324 9.907 NAD_C13-label-3 667.121765 9.912 NAD_C13-label-4 668.125366 9.931 NAD_C13-label-5 669.128662 9.902 NAD_C13-label-8 672.143494 9.957 Nicotinamide_C12 PARENT 123.055176 1.968 Nicotinamide_C13-label-1 124.058525 1.968 Nicotinamide_C13-label-2 125.06176 1.976 N-Methyl-L-glutamate_C12 PARENT 162.075745 7.537 O-Phosphorylethanolamine_C12 PARENT 142.025986 10.651 O-Phosphorylethanolamine_C13-label-1 143.029388 10.614 Ophthalmate_C12 PARENT 290.133636 8.947 Ornithine_C12 PARENT 133.096786 10.95 Phenylacetaldehyde_C12 PARENT 121.064774 1.224 Phenylacetaldehyde_C13-label-1 122.068069 1.224 Phenylacetaldehyde_C13-label-8 129.090836 1.276 Phenylalanine_C12 PARENT 166.085892 3.716 Phenylalanine_C13-label-1 167.089188 3.709 Phenylalanine_C13-label-2 168.092804 3.68 Phosphocholine_C12 PARENT 184.072937 11.265 Phosphocholine_C13-label-1 185.076218 11.257 Proline_C12 PARENT 116.070602 5.781 Proline_C13-label-1 117.07386 5.803 Proline_C13-label-2 118.077141 5.805 Pyridoxal_C12 PARENT 168.065262 2.622 Pyridoxal_C13-label-1 169.068405 2.601 Pyridoxal_C13-label-6 174.087051 2.6 S-Adenosyl-homocysteine_C12 PARENT 385.127716 7.707 S-Adenosyl-homocysteine_C13-label-1 386.132294 7.695 S-Adenosylmethionine_C12 PARENT 399.143616 10.318 S-Adenosylmethionine_C13-label-1 400.146637 10.303 S-Adenosylmethionine_C13-label-2 401.150269 10.317 Serine_C12 PARENT 106.049934 7.77 Serine_C13-label-1 107.053322 7.724 Succinyl-CoA_C12 PARENT 868.133301 10.395 Succinyl-CoA_C13-label-1 869.135681 10.392 Taurine_C12 PARENT 126.021759 5.568 Taurine_C13-label-1 127.025009 5.566 Taurine_C13-label-2 128.028214 5.744 Thiamine pyrophosphate_C12 PARENT 425.04306 12.87 Threonine_C12 PARENT 120.06543 7.041 Threonine_C13-label-1 121.06881 6.983 Trimethylglycine (Betaine)_C12 PARENT 118.086197 4.885 Trimethylglycine (Betaine)_C13-label-1 119.089424 4.895 Trimethylglycine (Betaine)_C13-label-2 120.092766 4.899 Tryptophan_C12 PARENT 205.096634 3.457 Tryptophan_C13-label-1 206.100296 3.458 Tryptophan_C13-label-2 207.103485 3.457 Tryptophan_C13-label-6 211.118317 3.492 Tryptophan_C13-label-7 212.121826 3.472 Tyrosine_C12 PARENT 182.080856 5.278 Tyrosine_C13-label-1 183.084045 5.286 Tyrosine_C13-label-2 184.088242 5.248 UDP_C12 PARENT 405.008179 10.628 UDP_C13-label-4 409.026459 10.694 UDP_C13-label-6 411.026917 10.747 UDP_C13-label-9 414.043549 10.56 UDP-N-acetylglucosamine_C12 PARENT 608.086548 10.173 UDP-N-acetylglucosamine_C13-label-1 609.089905 10.187 UDP-N-acetylglucosamine_C13-label-10 618.127197 10.146 UDP-N-acetylglucosamine_C13-label-16 624.139343 10.205 UDP-N-acetylglucosamine_C13-label-2 610.094055 10.23 UDP-N-acetylglucosamine_C13-label-4 612.10022 10.159 UMP_C12 PARENT 325.042145 10.246 UMP_C13-label-1 326.045471 10.254 UMP_C13-label-2 327.047302 10.213 Uracil_C12 PARENT 113.03463 2.253 Uracil_C13-label-1 114.037918 2.83 Uridine_C12 PARENT 245.077988 3.245 Uridine_C13-label-2 247.084671 3.169 Uridine_C13-label-1 246.080704 3.134 Uridine_C13-label-3 248.088913 2.928 Urocanate_C12 PARENT 139.04982 5.224 Urocanate_C13-label-1 140.053207 5.236 Urocanate_C13-label-2 141.05658 5.216 UTP_C12 PARENT 484.974213 13.218 UTP_C13-label-1 485.976349 13.126 UTP_C13-label-6 490.999634 13.178 Valine_C12 PARENT 118.086205 5.92 Valine_C13-label-1 119.089432 6.047 XMP_C12 PARENT 365.048279 10.473 XMP_C13-label-1 366.052002 10.44 XMP_C13-label-4 369.061798 10.402 Glucose 6-phosphate_C12 PARENT 261.036224 11.778 Glucose 6-phosphate_C13-label-1 262.039764 11.75 Glucose 6-phosphate_C13-label-2 263.04129 11.792 Glucose 6-phosphate_C13-label-3 264.046539 11.781 Glucose 6-phosphate_C13-label-4 265.049957 11.822 Glucose 6-phosphate_C13-label-5 266.052673 11.758 Glucose 6-phosphate_C13-label-6 267.056854 11.727 METABOLITES_END #END